6-methyl-N-(3-phenylpropyl)-2-[1-(phenylsulfonyl)piperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: 6-methyl-N-(3-phenylpropyl)-2-[1-(phenylsulfonyl)piperidin-4-yl]pyridine-3-carboxamide Openeye Name: 2-[1-(benzenesulfonyl)-4-piperidyl]-6-methyl-N-(3-phenylpropyl)pyridine-3-carboxamide CAS Name: 2-[1-(benzenesulfonyl)-4-piperidinyl]-6-methyl-N-(3-phenylpropyl)-3-pyridinecarboxamide IUPAC Name: 2-[1-(benzenesulfonyl)piperidin-4-yl]-6-methyl-N-(3-phenylpropyl)pyridine-3-carboxamide Traditional Name: 2-(1-besyl-4-piperidyl)-6-methyl-N-(3-phenylpropyl)nicotinamide Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCCC2=CC=CC=C2)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCCC2=CC=CC=C2)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O3S/c1-21-14-15-25(27(31)28-18-8-11-22-9-4-2-5-10-22)26(29-21)23-16-19-30(20-17-23)34(32,33)24-12-6-3-7-13-24/h2-7,9-10,12-15,23H,8,11,16-20H2,1H3,(H,28,31)