N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-[(4-tert-butylphenyl)methyl]-3-pyrazolyl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(4-tert-butylbenzyl)pyrazol-3-yl]-1-tosyl-isonipecotamide Formula: C27H34N4O3S MolecularWeight: 494.64886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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