1-(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)-N-[2-(4-methylphenyl)sulfanylethyl]piperidine-3-carboxamide

Systemtic Name: 1-(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)-N-[2-(4-methylphenyl)sulfanylethyl]piperidine-3-carboxamide Openeye Name: 1-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)-N-[2-(p-tolylsulfanyl)ethyl]piperidine-3-carboxamide CAS Name: 1-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)-N-[2-[(4-methylphenyl)thio]ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)-N-[2-(4-methylphenyl)sulfanylethyl]piperidine-3-carboxamide Traditional Name: 1-(6-chloro-2-keto-4-phenyl-1H-quinolin-3-yl)-N-[2-(p-tolylthio)ethyl]nipecotamide Formula: C30H30ClN3O2S MolecularWeight: 532.0961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2CCCN(C2)C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2CCCN(C2)C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

InChI

InChI=1S/C30H30ClN3O2S/c1-20-9-12-24(13-10-20)37-17-15-32-29(35)22-8-5-16-34(19-22)28-27(21-6-3-2-4-7-21)25-18-23(31)11-14-26(25)33-30(28)36/h2-4,6-7,9-14,18,22H,5,8,15-17,19H2,1H3,(H,32,35)(H,33,36)