N-[3-(2,3-dihydroindol-1-yl)propyl]-1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-[3-(2,3-dihydroindol-1-yl)propyl]-1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-(3-indolin-1-ylpropyl)-1-(p-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: N-[3-(2,3-dihydroindol-1-yl)propyl]-1-[(4-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[3-(2,3-dihydroindol-1-yl)propyl]-1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(3-indolin-1-ylpropyl)-1-(4-methylbenzyl)sulfonyl-isonipecotamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NCCCN3CCC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NCCCN3CCC4=CC=CC=C43

InChI

InChI=1S/C25H33N3O3S/c1-20-7-9-21(10-8-20)19-32(30,31)28-17-12-23(13-18-28)25(29)26-14-4-15-27-16-11-22-5-2-3-6-24(22)27/h2-3,5-10,23H,4,11-19H2,1H3,(H,26,29)