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Details

Stereochemistry ACHIRAL
Molecular Formula C16H10ClN3OS
Molecular Weight 327.788
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (6-CHLORO-3-HYDROXY-4-PHENYL-3LAMBDA(5)-QUINAZOLIN-2-YL)METHYL THIOCYANATE

SMILES

[O-][N+]1=C(CSC#N)N=C2C=CC(Cl)=CC2=C1C3=CC=CC=C3

InChI

InChIKey=YROBDNZTTZNXLP-UHFFFAOYSA-N
InChI=1S/C16H10ClN3OS/c17-12-6-7-14-13(8-12)16(11-4-2-1-3-5-11)20(21)15(19-14)9-22-10-18/h1-8H,9H2

HIDE SMILES / InChI

Approval Year

Name Type Language
(6-CHLORO-3-HYDROXY-4-PHENYL-3LAMBDA(5)-QUINAZOLIN-2-YL)METHYL THIOCYANATE
Systematic Name English
NSC-286151
Preferred Name English
6-chloro-2-[(cyanosulfanyl)methyl]-4-phenylquinazolin-3-ium-3-olate
Systematic Name English
Thiocyanic acid, (6-chloro-4-phenyl-2-quinazolinyl)methyl ester, N-oxide
Common Name English
Thiocyanic acid, (6-chloro-3-oxido-4-phenyl-2-quinazolinyl)methyl ester
Common Name English
Thiocyanic acid, (6-chloro-4-phenyl-2-quinazolinyl)methyl ester 3-oxide
Common Name English
Quinazoline, 6-chloro-4-phenyl-2-(thiocyanatomethyl)-, 3-oxide
Systematic Name English
Code System Code Type Description
FDA UNII
SC4P44CU2D
Created by admin on Tue Apr 01 20:03:52 GMT 2025 , Edited by admin on Tue Apr 01 20:03:52 GMT 2025
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EPA CompTox
DTXSID20181507
Created by admin on Tue Apr 01 20:03:52 GMT 2025 , Edited by admin on Tue Apr 01 20:03:52 GMT 2025
PRIMARY
PUBCHEM
494208
Created by admin on Tue Apr 01 20:03:52 GMT 2025 , Edited by admin on Tue Apr 01 20:03:52 GMT 2025
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NSC
286151
Created by admin on Tue Apr 01 20:03:52 GMT 2025 , Edited by admin on Tue Apr 01 20:03:52 GMT 2025
PRIMARY
CAS
27020-28-6
Created by admin on Tue Apr 01 20:03:52 GMT 2025 , Edited by admin on Tue Apr 01 20:03:52 GMT 2025
PRIMARY