N-[5-(4-methylphenyl)-2-phenyl-pyrazol-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[5-(4-methylphenyl)-2-phenyl-pyrazol-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: 1-methylsulfonyl-N-[2-phenyl-5-(p-tolyl)pyrazol-3-yl]piperidine-4-carboxamide CAS Name: N-[5-(4-methylphenyl)-2-phenyl-3-pyrazolyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[5-(4-methylphenyl)-2-phenylpyrazol-3-yl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: 1-mesyl-N-[2-phenyl-5-(p-tolyl)pyrazol-3-yl]isonipecotamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O3S/c1-17-8-10-18(11-9-17)21-16-22(27(25-21)20-6-4-3-5-7-20)24-23(28)19-12-14-26(15-13-19)31(2,29)30/h3-11,16,19H,12-15H2,1-2H3,(H,24,28)