N-[2-(1H-indol-3-yl)ethyl]-6-methyl-2-[1-(phenylmethyl)sulfonylpiperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-6-methyl-2-[1-(phenylmethyl)sulfonylpiperidin-4-yl]pyridine-3-carboxamide Openeye Name: 2-(1-benzylsulfonyl-4-piperidyl)-N-[2-(1H-indol-3-yl)ethyl]-6-methyl-pyridine-3-carboxamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-6-methyl-2-[1-(phenylmethyl)sulfonyl-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: 2-(1-benzylsulfonylpiperidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]-6-methylpyridine-3-carboxamide Traditional Name: 2-(1-benzylsulfonyl-4-piperidyl)-N-[2-(1H-indol-3-yl)ethyl]-6-methyl-nicotinamide Formula: C29H32N4O3S MolecularWeight: 516.65438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCC2=CNC3=CC=CC=C32)C4CCN(CC4)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCC2=CNC3=CC=CC=C32)C4CCN(CC4)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C29H32N4O3S/c1-21-11-12-26(29(34)30-16-13-24-19-31-27-10-6-5-9-25(24)27)28(32-21)23-14-17-33(18-15-23)37(35,36)20-22-7-3-2-4-8-22/h2-12,19,23,31H,13-18,20H2,1H3,(H,30,34)