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

Systemtic Name: 1-(4-tert-butylphenyl)sulfonyl-N-[phenyl(pyridin-2-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-(4-tert-butylphenyl)sulfonyl-N-[phenyl(2-pyridyl)methyl]piperidine-4-carboxamide CAS Name: 1-(4-tert-butylphenyl)sulfonyl-N-[phenyl(2-pyridinyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-tert-butylphenyl)sulfonyl-N-[phenyl(pyridin-2-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-(4-tert-butylphenyl)sulfonyl-N-[phenyl(2-pyridyl)methyl]isonipecotamide Formula: C28H33N3O3S MolecularWeight: 491.64492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=N4

InChI

InChI=1S/C28H33N3O3S/c1-28(2,3)23-12-14-24(15-13-23)35(33,34)31-19-16-22(17-20-31)27(32)30-26(21-9-5-4-6-10-21)25-11-7-8-18-29-25/h4-15,18,22,26H,16-17,19-20H2,1-3H3,(H,30,32)