N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]isonipecotamide Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O3S/c1-18-23(19(2)28(26-18)21-9-5-3-6-10-21)17-25-24(29)20-13-15-27(16-14-20)32(30,31)22-11-7-4-8-12-22/h3-12,20H,13-17H2,1-2H3,(H,25,29)