N-(4-tert-butylphenyl)-1-(4-cyanophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-1-(4-cyanophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(4-tert-butylphenyl)-1-(4-cyanophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(4-tert-butylphenyl)-1-(4-cyanophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(4-tert-butylphenyl)-1-(4-cyanophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-tert-butylphenyl)-1-(4-cyanophenyl)sulfonyl-isonipecotamide Formula: C23H27N3O3S MolecularWeight: 425.54378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H27N3O3S/c1-23(2,3)19-6-8-20(9-7-19)25-22(27)18-12-14-26(15-13-18)30(28,29)21-10-4-17(16-24)5-11-21/h4-11,18H,12-15H2,1-3H3,(H,25,27)