N-(1-methylsulfonylpiperidin-4-yl)-3-phenyl-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-(1-methylsulfonylpiperidin-4-yl)-3-phenyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(1-methylsulfonyl-4-piperidyl)-3-phenyl-pyrazole-4-carboxamide CAS Name: N-(1-methylsulfonyl-4-piperidinyl)-3-phenyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(1-methylsulfonylpiperidin-4-yl)-3-phenylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(1-mesyl-4-piperidyl)-3-phenyl-pyrazole-4-carboxamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC(=O)C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC(=O)C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O3S/c1-31(29,30)27-14-12-20(13-15-27)24-23(28)21-17-26(16-18-8-4-2-5-9-18)25-22(21)19-10-6-3-7-11-19/h2-11,17,20H,12-16H2,1H3,(H,24,28)