1-(5-tert-butyl-2-methyl-phenyl)sulfonyl-N-[2-(phenylmethyl)pyrazol-3-yl]piperidine-4-carboxamide

Systemtic Name: 1-(5-tert-butyl-2-methyl-phenyl)sulfonyl-N-[2-(phenylmethyl)pyrazol-3-yl]piperidine-4-carboxamide Openeye Name: N-(2-benzylpyrazol-3-yl)-1-(5-tert-butyl-2-methyl-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-(5-tert-butyl-2-methylphenyl)sulfonyl-N-[2-(phenylmethyl)-3-pyrazolyl]-4-piperidinecarboxamide IUPAC Name: N-(2-benzylpyrazol-3-yl)-1-(5-tert-butyl-2-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-benzylpyrazol-3-yl)-1-(5-tert-butyl-2-methyl-phenyl)sulfonyl-isonipecotamide Formula: C27H34N4O3S MolecularWeight: 494.64886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=NN3CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=NN3CC4=CC=CC=C4

InChI

InChI=1S/C27H34N4O3S/c1-20-10-11-23(27(2,3)4)18-24(20)35(33,34)30-16-13-22(14-17-30)26(32)29-25-12-15-28-31(25)19-21-8-6-5-7-9-21/h5-12,15,18,22H,13-14,16-17,19H2,1-4H3,(H,29,32)