7-chloranyl-3-(2-methylphenyl)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(2-methylphenyl)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-4-one Openeye Name: 7-chloro-3-(o-tolyl)-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 7-chloro-3-(2-methylphenyl)-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-4-quinazolinone IUPAC Name: 7-chloro-3-(2-methylphenyl)-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylquinazolin-4-one Traditional Name: 7-chloro-2-[(2-keto-2-piperidino-ethyl)thio]-3-(o-tolyl)quinazolin-4-one Formula: C22H22ClN3O2S MolecularWeight: 427.94698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)N4CCCCC4

InChI

InChI=1S/C22H22ClN3O2S/c1-15-7-3-4-8-19(15)26-21(28)17-10-9-16(23)13-18(17)24-22(26)29-14-20(27)25-11-5-2-6-12-25/h3-4,7-10,13H,2,5-6,11-12,14H2,1H3