CHEBI:93342 - 2-[(4-chlorophenyl)methylthio]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-[(4-chlorophenyl)methylthio]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one
ChEBI ID CHEBI:93342
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C14H13ClN2OS
Net Charge 0
Average Mass 292.785
Monoisotopic Mass 292.04371
InChI InChI=1S/C14H13ClN2OS/c15-10-6-4-9(5-7-10)8-19-14-16-12-3-1-2-11(12)13(18)17-14/h4-7H,1-3,8H2,(H,16,17,18)
InChIKey HKDAECHYHSQLRG-UHFFFAOYSA-N
SMILES C1CC2=C(C1)NC(=NC2=O)SCC3=CC=C(C=C3)Cl
ChEBI Ontology
Outgoing 2-[(4-chlorophenyl)methylthio]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one (CHEBI:93342) is a aryl sulfide (CHEBI:35683)
Manual Xref Database
LSM-3708 LINCS
View more database links