(3S)-N-[3-(3-methylphenyl)phenyl]-1-(thian-4-yl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-[3-(3-methylphenyl)phenyl]-1-(thian-4-yl)piperidine-3-carboxamide Openeye Name: (3S)-N-[3-(m-tolyl)phenyl]-1-tetrahydrothiopyran-4-yl-piperidine-3-carboxamide CAS Name: (3S)-N-[3-(3-methylphenyl)phenyl]-1-(4-thianyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-[3-(3-methylphenyl)phenyl]-1-(thian-4-yl)piperidine-3-carboxamide Traditional Name: (3S)-N-[3-(m-tolyl)phenyl]-1-tetrahydrothiopyran-4-yl-nipecotamide Formula: C24H30N2OS MolecularWeight: 394.5728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC(=CC=C2)NC(=O)C3CCCN(C3)C4CCSCC4

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC(=CC=C2)NC(=O)[C@H]3CCCN(C3)C4CCSCC4

InChI

InChI=1S/C24H30N2OS/c1-18-5-2-6-19(15-18)20-7-3-9-22(16-20)25-24(27)21-8-4-12-26(17-21)23-10-13-28-14-11-23/h2-3,5-7,9,15-16,21,23H,4,8,10-14,17H2,1H3,(H,25,27)/t21-/m0/s1