N-[2-(azepan-1-yl)phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-1-(benzenesulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(1-azepanyl)phenyl]-1-(benzenesulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-1-(benzenesulfonyl)piperidine-4-carboxamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-1-besyl-isonipecotamide Formula: C24H31N3O3S MolecularWeight: 441.58624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H31N3O3S/c28-24(25-22-12-6-7-13-23(22)26-16-8-1-2-9-17-26)20-14-18-27(19-15-20)31(29,30)21-10-4-3-5-11-21/h3-7,10-13,20H,1-2,8-9,14-19H2,(H,25,28)