1-[(3-methylphenyl)methylsulfonyl]-N-[2-(propylcarbamoyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3-methylphenyl)methylsulfonyl]-N-[2-(propylcarbamoyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(m-tolylmethylsulfonyl)-N-[2-(propylcarbamoyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[(3-methylphenyl)methylsulfonyl]-N-[2-[oxo(propylamino)methyl]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-methylphenyl)methylsulfonyl]-N-[2-(propylcarbamoyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(3-methylbenzyl)sulfonyl-N-[2-(propylcarbamoyl)phenyl]isonipecotamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC(=C3)C

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC(=C3)C

InChI

InChI=1S/C24H31N3O4S/c1-3-13-25-24(29)21-9-4-5-10-22(21)26-23(28)20-11-14-27(15-12-20)32(30,31)17-19-8-6-7-18(2)16-19/h4-10,16,20H,3,11-15,17H2,1-2H3,(H,25,29)(H,26,28)