N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[2-[(3-chlorophenyl)methyl]-3-pyrazolyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[2-(3-chlorobenzyl)pyrazol-3-yl]isonipecotamide Formula: C22H23ClN4O3S MolecularWeight: 458.96102

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=NN2CC3=CC(=CC=C3)Cl)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=NN2CC3=CC(=CC=C3)Cl)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H23ClN4O3S/c23-19-6-4-5-17(15-19)16-27-21(9-12-24-27)25-22(28)18-10-13-26(14-11-18)31(29,30)20-7-2-1-3-8-20/h1-9,12,15,18H,10-11,13-14,16H2,(H,25,28)