3-(4-chlorophenyl)-2-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-chlorophenyl)-2-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(4-chlorophenyl)-2-[2-(2-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(4-chlorophenyl)-2-[[2-(2-methyl-1-piperidinyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-(4-chlorophenyl)-2-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-(4-chlorophenyl)-2-[[2-keto-2-(2-methylpiperidino)ethyl]thio]quinazolin-4-one Formula: C22H22ClN3O2S MolecularWeight: 427.94698

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1CCCCN1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O2S/c1-15-6-4-5-13-25(15)20(27)14-29-22-24-19-8-3-2-7-18(19)21(28)26(22)17-11-9-16(23)10-12-17/h2-3,7-12,15H,4-6,13-14H2,1H3