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

Systemtic Name: 3-(4-methylphenyl)-2-(2-oxidanylidenepropylsulfanyl)quinazolin-4-one Openeye Name: 2-acetonylsulfanyl-3-(p-tolyl)quinazolin-4-one CAS Name: 3-(4-methylphenyl)-2-(2-oxopropylthio)-4-quinazolinone IUPAC Name: 3-(4-methylphenyl)-2-(2-oxopropylsulfanyl)quinazolin-4-one Traditional Name: 2-(acetonylthio)-3-(p-tolyl)quinazolin-4-one Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C

InChI

InChI=1S/C18H16N2O2S/c1-12-7-9-14(10-8-12)20-17(22)15-5-3-4-6-16(15)19-18(20)23-11-13(2)21/h3-10H,11H2,1-2H3