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Details

Stereochemistry ACHIRAL
Molecular Formula C17H15ClN4O2
Molecular Weight 342.78
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(4-(3-CHLORO-4-HYDROXY-ANILINO)QUINAZOLIN-6-YL)PROPANAMIDE

SMILES

CCC(=O)NC1=CC2=C(NC3=CC=C(O)C(Cl)=C3)N=CN=C2C=C1

InChI

InChIKey=MRFANFCENWPANW-UHFFFAOYSA-N
InChI=1S/C17H15ClN4O2/c1-2-16(24)21-10-3-5-14-12(7-10)17(20-9-19-14)22-11-4-6-15(23)13(18)8-11/h3-9,23H,2H2,1H3,(H,21,24)(H,19,20,22)

HIDE SMILES / InChI

Molecular Formula C17H15ClN4O2
Molecular Weight 342.78
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 16:07:50 GMT 2023
Edited
by admin
on Sat Dec 16 16:07:50 GMT 2023
Record UNII
WA7FF8L9QZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(4-(3-CHLORO-4-HYDROXY-ANILINO)QUINAZOLIN-6-YL)PROPANAMIDE
Systematic Name English
ALLITINIB METABOLITE M2
Common Name English
Code System Code Type Description
PUBCHEM
156596729
Created by admin on Sat Dec 16 16:07:50 GMT 2023 , Edited by admin on Sat Dec 16 16:07:50 GMT 2023
PRIMARY
FDA UNII
WA7FF8L9QZ
Created by admin on Sat Dec 16 16:07:50 GMT 2023 , Edited by admin on Sat Dec 16 16:07:50 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
FECAL; PLASMA