1-(1-methylindol-5-yl)sulfonyl-N-[(2-methylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(1-methylindol-5-yl)sulfonyl-N-[(2-methylphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(1-methylindol-5-yl)sulfonyl-N-(o-tolylmethyl)piperidine-4-carboxamide CAS Name: 1-[(1-methyl-5-indolyl)sulfonyl]-N-[(2-methylphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(1-methylindol-5-yl)sulfonyl-N-[(2-methylphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-(2-methylbenzyl)-1-(1-methylindol-5-yl)sulfonyl-isonipecotamide Formula: C23H27N3O3S MolecularWeight: 425.54378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)N(C=C4)C

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)N(C=C4)C

InChI

InChI=1S/C23H27N3O3S/c1-17-5-3-4-6-20(17)16-24-23(27)18-10-13-26(14-11-18)30(28,29)21-7-8-22-19(15-21)9-12-25(22)2/h3-9,12,15,18H,10-11,13-14,16H2,1-2H3,(H,24,27)