N-[2-(phenylmethyl)pyrazol-3-yl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(phenylmethyl)pyrazol-3-yl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-benzylpyrazol-3-yl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(phenylmethyl)-3-pyrazolyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-benzylpyrazol-3-yl)-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-benzylpyrazol-3-yl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-isonipecotamide Formula: C26H32N4O3S MolecularWeight: 480.62228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=NN3CC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=NN3CC4=CC=CC=C4)C)C

InChI

InChI=1S/C26H32N4O3S/c1-18-16-19(2)21(4)25(20(18)3)34(32,33)29-14-11-23(12-15-29)26(31)28-24-10-13-27-30(24)17-22-8-6-5-7-9-22/h5-10,13,16,23H,11-12,14-15,17H2,1-4H3,(H,28,31)