N-methyl-2-methylsulfanyl-N-[(3S)-1-(3-phenylpropyl)piperidin-3-yl]pyridine-3-carboxamide

Systemtic Name: N-methyl-2-methylsulfanyl-N-[(3S)-1-(3-phenylpropyl)piperidin-3-yl]pyridine-3-carboxamide Openeye Name: N-methyl-2-methylsulfanyl-N-[(3S)-1-(3-phenylpropyl)-3-piperidyl]pyridine-3-carboxamide CAS Name: N-methyl-2-(methylthio)-N-[(3S)-1-(3-phenylpropyl)-3-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-methyl-2-methylsulfanyl-N-[(3S)-1-(3-phenylpropyl)piperidin-3-yl]pyridine-3-carboxamide Traditional Name: N-methyl-2-(methylthio)-N-[(3S)-1-(3-phenylpropyl)-3-piperidyl]nicotinamide Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCN(C1)CCCC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CN([C@H]1CCCN(C1)CCCC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C22H29N3OS/c1-24(22(26)20-13-6-14-23-21(20)27-2)19-12-8-16-25(17-19)15-7-11-18-9-4-3-5-10-18/h3-6,9-10,13-14,19H,7-8,11-12,15-17H2,1-2H3/t19-/m0/s1