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Details

Stereochemistry UNKNOWN
Molecular Formula C17H15ClN4O4
Molecular Weight 374.778
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(4-((3-CHLORO-4-HYDROXYPHENYL)AMINO)-6-QUINAZOLINYL)-2,3-DIHYDROXYPROPANAMIDE

SMILES

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

InChI

InChIKey=BSLKOTBSDTUPHX-UHFFFAOYSA-N
InChI=1S/C17H15ClN4O4/c18-12-6-10(2-4-14(12)24)21-16-11-5-9(22-17(26)15(25)7-23)1-3-13(11)19-8-20-16/h1-6,8,15,23-25H,7H2,(H,22,26)(H,19,20,21)

HIDE SMILES / InChI

Molecular Formula C17H15ClN4O4
Molecular Weight 374.778
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:08:25 GMT 2023
Edited
by admin
on Sat Dec 16 16:08:25 GMT 2023
Record UNII
AWA4RT5H6W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(4-((3-CHLORO-4-HYDROXYPHENYL)AMINO)-6-QUINAZOLINYL)-2,3-DIHYDROXYPROPANAMIDE
Systematic Name English
ALLITINIB METABOLITE M5
Common Name English
PROPANAMIDE, N-(4-((3-CHLORO-4-HYDROXYPHENYL)AMINO)-6-QUINAZOLINYL)-2,3-DIHYDROXY-
Systematic Name English
Code System Code Type Description
PUBCHEM
156596397
Created by admin on Sat Dec 16 16:08:25 GMT 2023 , Edited by admin on Sat Dec 16 16:08:25 GMT 2023
PRIMARY
CAS
1636145-47-5
Created by admin on Sat Dec 16 16:08:25 GMT 2023 , Edited by admin on Sat Dec 16 16:08:25 GMT 2023
PRIMARY
FDA UNII
AWA4RT5H6W
Created by admin on Sat Dec 16 16:08:25 GMT 2023 , Edited by admin on Sat Dec 16 16:08:25 GMT 2023
PRIMARY
Related Record Type Details
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