2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-pyridin-3-yl-quinazolin-4-one

Systemtic Name: 2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-pyridin-3-yl-quinazolin-4-one Openeye Name: 2-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-3-(3-pyridyl)quinazolin-4-one CAS Name: 2-[[2-(4-methylphenyl)-2-oxoethyl]thio]-3-(3-pyridinyl)-4-quinazolinone IUPAC Name: 2-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-3-pyridin-3-ylquinazolin-4-one Traditional Name: 2-[[2-keto-2-(p-tolyl)ethyl]thio]-3-(3-pyridyl)quinazolin-4-one Formula: C22H17N3O2S MolecularWeight: 387.45428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CN=CC=C4

InChI

InChI=1S/C22H17N3O2S/c1-15-8-10-16(11-9-15)20(26)14-28-22-24-19-7-3-2-6-18(19)21(27)25(22)17-5-4-12-23-13-17/h2-13H,14H2,1H3