Compound Summary

azathioprine
  Compound Information
 azathioprine

Compound Name:

azathioprine

Compound CID:

2265

Synonyms:

azathioprine

446-86-6

Imuran

Azothioprine

Azathioprin

More...

Iupac Name:

6-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-7H-purine

InChI:

InChI=1S/C9H7N7O2S/c1-15-4-14-7(16(17)18)9(15)19-8-5-6(11-2-10-5)12-3-13-8/h2-4H,1H3,(H,10,11,12,13)

InChIKey:

LMEKQMALGUDUQG-UHFFFAOYSA-N

Canonical Smiles:

CN1C=NC(=C1SC2=NC=NC3=C2NC=N3)[N+](=O)[O-]

Isomeric Smiles:

CN1C=NC(=C1SC2=NC=NC3=C2NC=N3)[N+](=O)[O-]

Molecular Weight:

277.27

Molecular Formula:

C9H7N7O2S

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 azathioprine

Molecular Weight:

277.27

Molecular Formula:

C9H7N7O2S

Hydrogen Bond Donor Count:

1

Hydrogen Bond Acceptor Count:

7

Rotatable Bond Count:

2

Heavy Atom Count:

19

Complexity:

354

  Synonyms
 azathioprine

azathioprine azathioprine

azathioprine

446-86-6

Imuran

Azothioprine

Azathioprin

Azatioprin

Azamun

Azanin

Imurel

Azathiopurine

Azasan

Ccucol

Imurek

Muran

Rorasul

BW 57-322

NSC-39084

BW-57-322

NCI-C03474

6-(1-Methyl-4-nitroimidazol-5-yl)thiopurine

6-(1-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl-7H-purine

Imuran (TN)

NSC 39084

6-(1-Methyl-p-nitro-5-imidazolyl)-thiopurine

6-((1-Methyl-4-nitro-1H-imidazol-5-yl)thio)-1H-purine

UNII-MRK240IY2L

6-(1-Methyl-4-nitro-5-imidazolyl)-mercaptopurine

6-((1-Methyl-4-nitro-1H-imidazol-5-yl)thio)-9H-purine

6-((1-Methyl-4-nitroimidazol-5-yl)thio)purine

Azathioprine (Azasan, Imuran)

1H-Purine, 6-((1-methyl-4-nitro-1H-imidazol-5-yl)thio)-

1H-Purine, 6-(1-methyl-4-nitro-1H-imidazol-5-yl)thio-

Purine, 6-(1-methyl-4-nitro-5-imidazolylthio)-

6-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-7H-purine

6-(Methyl-p-nitro-5-imidazolyl)-thiopurine

MFCD00069203

MRK240IY2L

BW 57322

Azamun Czech

6-((1-methyl-4-nitro-1H-imidazol-5-yl)thio)-7H-purine

CHEBI:2948

B. W. 57-322

NSC39084

6-(1-Methyl-4-nitro-5-imidazolyl)mercaptopurine

Purine, 6-((1-methyl-4-nitroimidazol-5-yl)thio)-

6-(1-methyl-4-nitro-1H-imidazol-5-yl)thio-7H-purine

6-(1-methyl-4-nitro-1H-imidazol-5-yl)thio-9H-purine

NCGC00015060-06

NCGC00015060-14

Azatioprina

CAS-446-86-6

DSSTox_CID_119

6-(1-Methyl-4-nitroimidazol-5-yl)thiopurine

DSSTox_RID_75381

DSSTox_GSID_20119

Azathioprinum INN-Latin

Azatioprina INN-Spanish

Azamune

Methylnitroimidazolylmercaptopurine

CCRIS 62

Azasan (TN)

HSDB 7084

SR-01000075537

Purine, 6-(1-methyl-4-nitroimidazol-5-yl)thio-

EINECS 207-175-4

6-(1-methyl-4-nitro-1H-imidazol-5-ylthio)-9H-purine

6-1-Methyl,4-nitro,5-imidazolyl mercaptopurine

azanine

6-(1-Methyl-4-nitroimidazol-5-ylthio)purin Czech

Azothioprin

Jayempi

Azoran

AI3-50290

6-(1-Methyl-4-nitroimidazol-5-ylthio)purin

Prestwick_41

Azathiopurine,(S)

Methyl(nitroimidazolyl)mercaptopurine

Azathioprine USAN:USP:INN:BAN:JAN

Spectrum_000064

Azathioprine, >=98%

6-(Methyl-p-nitro-5-imidazolyl)thiopurine

Prestwick0_000094

Prestwick1_000094

Prestwick2_000094

Prestwick3_000094

Spectrum2_000068

Spectrum3_000308

Spectrum4_000243

Spectrum5_000848

Lopac-A-4638

ChemDiv1_002659

6-(1-Methyl-p-nitro-5-imidazolyl)thiopurine

A 4638

Thiopurine 6-(1-methyl-4-nitroimidazol-5-yl)

SCHEMBL4278

CHEMBL1542

Lopac0_000027

Oprea1_375441

Oprea1_533384

Oprea1_633462

BSPBio_000048

BSPBio_001876

CBDivE_013132

KBioGR_000646

KBioGR_002427

KBioSS_000464

KBioSS_002433

MLS001049307

DivK1c_000586

SPECTRUM1500133

SPBio_000255

SPBio_001987

BPBio1_000054

GTPL7120

DTXSID4020119

Azathioprine (JP17/USP/INN)

HMS501N08

HMS594I19

KBio1_000586

KBio2_000464

KBio2_002427

KBio2_003032

KBio2_004995

KBio2_005600

KBio2_007563

KBio3_001376

KBio3_002906

cMAP_000046

NINDS_000586

6-(1-Methyl-4-nitro-1H-imidazol-5-yl)sulfanyl-1H-purine

HMS1568C10

HMS1920E17

HMS2091K19

HMS2095C10

HMS2802J03

HMS3259P03

HMS3260E15

HMS3655M04

HMS3712C10

Pharmakon1600-01500133

ACT02232

BCP09492

HY-B0256

ZINC4258316

Tox21_110074

Tox21_400024

Tox21_500027

BDBM50373919

CCG-16168

CCG-39877

NSC755900

s1721

STK831906

AKOS005609209

AKOS028108935

Tox21_110074_1

AC-4230

CCG-220094

DB00993

KS-1146

LP00027

MCULE-8637589610

NC00614

NSC-755900

SDCCGMLS-0065415.P001

SDCCGSBI-0050016.P005

IDI1_000586

NCGC00015060-01

NCGC00015060-02

NCGC00015060-03

NCGC00015060-04

NCGC00015060-05

NCGC00015060-07

NCGC00015060-08

NCGC00015060-09

NCGC00015060-10

NCGC00015060-11

NCGC00015060-12

NCGC00015060-13

NCGC00015060-15

NCGC00015060-16

NCGC00015060-18

NCGC00015060-19

NCGC00015060-29

NCGC00090836-01

NCGC00090836-02

NCGC00090836-03

NCGC00090836-04

NCGC00090836-05

NCGC00090836-06

NCGC00094593-01

NCGC00094593-02

NCGC00094593-03

NCGC00260712-01

BA166065

L996

SMR000427366

6-1-Methyl,5-imidazolyl mercaptopurine

SBI-0050016.P003

AB0014998

Azathioprine 100 microg/mL in Acetonitrile

6-(1-Methyl-4-nitromidazol-5-ylthio)purine

AB00443544

EU-0100027

FT-0602904

FT-0662375

SW198560-2

6-(1-Methyl-4-nitroimidazol-5-ylthio)purine

Azathioprine, meets USP testing specifications

1767-EP0930075A1

1767-EP2272822A1

1767-EP2272825A2

1767-EP2272827A1

1767-EP2272832A1

1767-EP2275420A1

1767-EP2277865A1

1767-EP2277876A1

1767-EP2281815A1

1767-EP2292227A2

1767-EP2292614A1

1767-EP2295409A1

1767-EP2295412A1

1767-EP2295413A1

1767-EP2295426A1

1767-EP2295427A1

1767-EP2298743A1

1767-EP2301933A1

1767-EP2311827A1

1767-EP2311837A1

1767-EP2314590A1

1767-EP2316834A1

1767-EP2371811A2

C06837

D00238

D70170

Q18939

AB00443544-03

AB00443544-11

AB00443544_12

AB00443544_13

055A974

446A866

A826664

SR-01000762955

6-(1-Methyl-4-nitro-5-imidazolythio)-9H-pur-ine

SR-01000075537-1

SR-01000075537-4

SR-01000762955-2

BRD-K32821942-001-05-6

BRD-K32821942-001-10-6

BRD-K60324116-001-01-5

WLN: T56 BM DN FN HNJ IS- ET5N CNJ A1 DNW

Z57063156

6-((1-methyl-4-nitro-1h-imidazol-5-yl)thio)-1h-purin

6-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-9H-purine

6-(1-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl-9H-purine

9H-Purine, 6-(1-methyl-4-nitro-1H-imidazol-5-yl)thio-

Azathioprine, European Pharmacopoeia (EP) Reference Standard

6-(1-Methyl-4-nitro-1H-imidazol-5-yl)sulfanyl-1H-purine #

Azathioprine, United States Pharmacopeia (USP) Reference Standard

Azathioprine, Pharmaceutical Secondary Standard; Certified Reference Material

  Experimental Data
 azathioprine

Species Dose Unit Control(Avg days) Treatment(Avg days) Avg/Med Lifespan Change(%) Control(Max days) Treatment(Max days) Max Lifespan Change(%) Significant Strain Gender PubMed Avg/Med Lifespan Change tab
Caenorhabditis elegans 33.000000000000000 umol/L -1.000000000000000 NS N2 24134630 Inactive
  Experimental Data Visualization
 azathioprine

  Statistics Data
 azathioprine

Species Avg/Med Lifespan Change(%) Max Lifespan Change(%) Count Reference Count Data point
Caenorhabditis elegans -1.000000000000000 1 1
  Statistics Data Visualization
 azathioprine

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