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

Systemtic Name: 1-(4-tert-butylphenyl)sulfonyl-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-(4-tert-butylphenyl)sulfonyl-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]piperidine-4-carboxamide CAS Name: 1-(4-tert-butylphenyl)sulfonyl-N-[[2-(1-pyrazolyl)-4-pyridinyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-tert-butylphenyl)sulfonyl-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-(4-tert-butylphenyl)sulfonyl-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]isonipecotamide Formula: C25H31N5O3S MolecularWeight: 481.61034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC(=NC=C3)N4C=CC=N4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC(=NC=C3)N4C=CC=N4

InChI

InChI=1S/C25H31N5O3S/c1-25(2,3)21-5-7-22(8-6-21)34(32,33)29-15-10-20(11-16-29)24(31)27-18-19-9-13-26-23(17-19)30-14-4-12-28-30/h4-9,12-14,17,20H,10-11,15-16,18H2,1-3H3,(H,27,31)