U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C14H12N4OS
Molecular Weight 284.336
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NOLATREXED

SMILES

CC1=C(SC2=CC=NC=C2)C3=C(C=C1)N=C(N)NC3=O

InChI

InChIKey=XHWRWCSCBDLOLM-UHFFFAOYSA-N
InChI=1S/C14H12N4OS/c1-8-2-3-10-11(13(19)18-14(15)17-10)12(8)20-9-4-6-16-7-5-9/h2-7H,1H3,(H3,15,17,18,19)

HIDE SMILES / InChI

Molecular Formula C14H12N4OS
Molecular Weight 284.336
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:35:33 UTC 2023
Edited
by admin
on Sat Dec 16 17:35:33 UTC 2023
Record UNII
K75ZUN743Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NOLATREXED
INN   MART.   MI   WHO-DD  
INN  
Official Name English
NOLATREXED [MI]
Common Name English
2-AMINO-6-METHYL-5-(4-PYRIDYLTHIO)-4(3H)-QUINAZOLINONE
Systematic Name English
2-AMINO-6-METHYL-5-(4-PYRIDINYLTHIO)-4(1H)-QUINAZOLINONE
Systematic Name English
NOLATREXED [MART.]
Common Name English
4(1H)-QUINAZOLINONE, 2-AMINO-6-METHYL-5-(4-PYRIDINYLTHIO)-
Systematic Name English
Nolatrexed [WHO-DD]
Common Name English
2-AMINO-3,4-DIHYDRO-6-METHYL-4-OXO-5-(4-PYRIDYLTHIO)QUINAZOLINE
Systematic Name English
nolatrexed [INN]
Common Name English
2-AMINO-6-METHYL-5-(PYRIDIN-4-YLSULFANYL)-3H-QUINAZOLIN-4-ONE
Systematic Name English
Classification Tree Code System Code
EU-Orphan Drug EU/3/03/165
Created by admin on Sat Dec 16 17:35:33 UTC 2023 , Edited by admin on Sat Dec 16 17:35:33 UTC 2023
FDA ORPHAN DRUG 148801
Created by admin on Sat Dec 16 17:35:33 UTC 2023 , Edited by admin on Sat Dec 16 17:35:33 UTC 2023
NCI_THESAURUS C2021
Created by admin on Sat Dec 16 17:35:34 UTC 2023 , Edited by admin on Sat Dec 16 17:35:34 UTC 2023
Code System Code Type Description
ChEMBL
CHEMBL320775
Created by admin on Sat Dec 16 17:35:33 UTC 2023 , Edited by admin on Sat Dec 16 17:35:33 UTC 2023
PRIMARY
PUBCHEM
135400184
Created by admin on Sat Dec 16 17:35:34 UTC 2023 , Edited by admin on Sat Dec 16 17:35:34 UTC 2023
PRIMARY
MESH
C099178
Created by admin on Sat Dec 16 17:35:33 UTC 2023 , Edited by admin on Sat Dec 16 17:35:33 UTC 2023
PRIMARY
SMS_ID
100000083585
Created by admin on Sat Dec 16 17:35:34 UTC 2023 , Edited by admin on Sat Dec 16 17:35:34 UTC 2023
PRIMARY
WIKIPEDIA
NOLATREXED
Created by admin on Sat Dec 16 17:35:34 UTC 2023 , Edited by admin on Sat Dec 16 17:35:34 UTC 2023
PRIMARY
NCI_THESAURUS
C143088
Created by admin on Sat Dec 16 17:35:33 UTC 2023 , Edited by admin on Sat Dec 16 17:35:33 UTC 2023
PRIMARY
EVMPD
SUB09342MIG
Created by admin on Sat Dec 16 17:35:33 UTC 2023 , Edited by admin on Sat Dec 16 17:35:33 UTC 2023
PRIMARY
INN
7683
Created by admin on Sat Dec 16 17:35:33 UTC 2023 , Edited by admin on Sat Dec 16 17:35:33 UTC 2023
PRIMARY
FDA UNII
K75ZUN743Q
Created by admin on Sat Dec 16 17:35:33 UTC 2023 , Edited by admin on Sat Dec 16 17:35:33 UTC 2023
PRIMARY
CAS
147149-76-6
Created by admin on Sat Dec 16 17:35:33 UTC 2023 , Edited by admin on Sat Dec 16 17:35:33 UTC 2023
PRIMARY
MERCK INDEX
m8029
Created by admin on Sat Dec 16 17:35:33 UTC 2023 , Edited by admin on Sat Dec 16 17:35:33 UTC 2023
PRIMARY Merck Index
DRUG BANK
DB12912
Created by admin on Sat Dec 16 17:35:33 UTC 2023 , Edited by admin on Sat Dec 16 17:35:33 UTC 2023
PRIMARY
EPA CompTox
DTXSID3048281
Created by admin on Sat Dec 16 17:35:33 UTC 2023 , Edited by admin on Sat Dec 16 17:35:33 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY