CHEBI:109582 - 7-chloro-3-[2-(1-cyclohexenyl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 7-chloro-3-[2-(1-cyclohexenyl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one
ChEBI ID CHEBI:109582
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H17ClN2OS
Net Charge 0
Average Mass 320.839
Monoisotopic Mass 320.07501
InChI InChI=1S/C16H17ClN2OS/c17-12-6-7-13-14(10-12)18-16(21)19(15(13)20)9-8-11-4-2-1-3-5-11/h4,6-7,10H,1-3,5,8-9H2,(H,18,21)
InChIKey HQOPYEXMXURNHR-UHFFFAOYSA-N
SMILES C1CCC(=CC1)CCN2C(=O)C3=C(C=C(C=C3)Cl)NC2=S
ChEBI Ontology
Outgoing 7-chloro-3-[2-(1-cyclohexenyl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one (CHEBI:109582) is a quinazolines (CHEBI:38530)
Manual Xref Database
LSM-21010 LINCS
View more database links