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Details

Stereochemistry ACHIRAL
Molecular Formula C17H16N2OS
Molecular Weight 296.387
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of QUINAZOLINE, 4-METHYL-2-(((4-METHYLPHENYL)THIO)METHYL)-, 3-OXIDE

SMILES

CC1=CC=C(SCC2=NC3=C(C=CC=C3)C(C)=N2=O)C=C1

InChI

InChIKey=WIPRPPXYIWITAW-UHFFFAOYSA-N
InChI=1S/C17H16N2OS/c1-12-7-9-14(10-8-12)21-11-17-18-16-6-4-3-5-15(16)13(2)19(17)20/h3-10H,11H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C17H16N2OS
Molecular Weight 296.387
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 Tue Apr 01 19:40:39 GMT 2025
Edited
by admin
on Tue Apr 01 19:40:39 GMT 2025
Record UNII
W45C4SCE47
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-64056
Preferred Name English
QUINAZOLINE, 4-METHYL-2-(((4-METHYLPHENYL)THIO)METHYL)-, 3-OXIDE
Systematic Name English
QUINAZOLINE, 4-METHYL-2-((P-TOLYLTHIO)METHYL)-, 3-OXIDE
Systematic Name English
Code System Code Type Description
CAS
7251-56-1
Created by admin on Tue Apr 01 19:40:39 GMT 2025 , Edited by admin on Tue Apr 01 19:40:39 GMT 2025
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EPA CompTox
DTXSID90222830
Created by admin on Tue Apr 01 19:40:39 GMT 2025 , Edited by admin on Tue Apr 01 19:40:39 GMT 2025
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FDA UNII
W45C4SCE47
Created by admin on Tue Apr 01 19:40:39 GMT 2025 , Edited by admin on Tue Apr 01 19:40:39 GMT 2025
PRIMARY
NSC
64056
Created by admin on Tue Apr 01 19:40:39 GMT 2025 , Edited by admin on Tue Apr 01 19:40:39 GMT 2025
PRIMARY
PUBCHEM
461817
Created by admin on Tue Apr 01 19:40:39 GMT 2025 , Edited by admin on Tue Apr 01 19:40:39 GMT 2025
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