1-(1-methylindol-5-yl)sulfonyl-N-[1-(phenylmethyl)piperidin-4-yl]piperidine-3-carboxamide

Systemtic Name: 1-(1-methylindol-5-yl)sulfonyl-N-[1-(phenylmethyl)piperidin-4-yl]piperidine-3-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-1-(1-methylindol-5-yl)sulfonyl-piperidine-3-carboxamide CAS Name: 1-[(1-methyl-5-indolyl)sulfonyl]-N-[1-(phenylmethyl)-4-piperidinyl]-3-piperidinecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-1-(1-methylindol-5-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-1-(1-methylindol-5-yl)sulfonyl-nipecotamide Formula: C27H34N4O3S MolecularWeight: 494.64886

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCC(C3)C(=O)NC4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCC(C3)C(=O)NC4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C27H34N4O3S/c1-29-15-11-22-18-25(9-10-26(22)29)35(33,34)31-14-5-8-23(20-31)27(32)28-24-12-16-30(17-13-24)19-21-6-3-2-4-7-21/h2-4,6-7,9-11,15,18,23-24H,5,8,12-14,16-17,19-20H2,1H3,(H,28,32)