N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]piperidine-4-carboxamide CAS Name: N-[3-[anilino(oxo)methyl]-1-ethyl-4-pyrazolyl]-1-(benzenesulfonyl)-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]isonipecotamide Formula: C24H27N5O4S MolecularWeight: 481.56728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H27N5O4S/c1-2-28-17-21(22(27-28)24(31)25-19-9-5-3-6-10-19)26-23(30)18-13-15-29(16-14-18)34(32,33)20-11-7-4-8-12-20/h3-12,17-18H,2,13-16H2,1H3,(H,25,31)(H,26,30)