3-(4-chlorophenyl)-2-(2-oxidanylidenepropylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(4-chlorophenyl)-2-(2-oxidanylidenepropylsulfanyl)quinazolin-4-one Openeye Name: 2-acetonylsulfanyl-3-(4-chlorophenyl)quinazolin-4-one CAS Name: 3-(4-chlorophenyl)-2-(2-oxopropylthio)-4-quinazolinone IUPAC Name: 3-(4-chlorophenyl)-2-(2-oxopropylsulfanyl)quinazolin-4-one Traditional Name: 2-(acetonylthio)-3-(4-chlorophenyl)quinazolin-4-one Formula: C17H13ClN2O2S MolecularWeight: 344.81532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H13ClN2O2S/c1-11(21)10-23-17-19-15-5-3-2-4-14(15)16(22)20(17)13-8-6-12(18)7-9-13/h2-9H,10H2,1H3