1-[3-(azepan-1-ylsulfonyl)phenyl]carbonyl-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[3-(azepan-1-ylsulfonyl)phenyl]carbonyl-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[3-(azepan-1-ylsulfonyl)benzoyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[[3-(1-azepanylsulfonyl)phenyl]-oxomethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[3-(azepan-1-ylsulfonyl)benzoyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[3-(azepan-1-ylsulfonyl)benzoyl]-N-phenyl-isonipecotamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O4S/c29-24(26-22-10-4-3-5-11-22)20-13-17-27(18-14-20)25(30)21-9-8-12-23(19-21)33(31,32)28-15-6-1-2-7-16-28/h3-5,8-12,19-20H,1-2,6-7,13-18H2,(H,26,29)