1-(5-cyanopyridin-2-yl)-N-[[4-(2-methylpropyl)phenyl]-thiophen-2-yl-methyl]piperidine-4-carboxamide

Systemtic Name: 1-(5-cyanopyridin-2-yl)-N-[[4-(2-methylpropyl)phenyl]-thiophen-2-yl-methyl]piperidine-4-carboxamide Openeye Name: 1-(5-cyano-2-pyridyl)-N-[(4-isobutylphenyl)-(2-thienyl)methyl]piperidine-4-carboxamide CAS Name: 1-(5-cyano-2-pyridinyl)-N-[[4-(2-methylpropyl)phenyl]-thiophen-2-ylmethyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-cyanopyridin-2-yl)-N-[[4-(2-methylpropyl)phenyl]-thiophen-2-ylmethyl]piperidine-4-carboxamide Traditional Name: 1-(5-cyano-2-pyridyl)-N-[(4-isobutylphenyl)-(2-thienyl)methyl]isonipecotamide Formula: C27H30N4OS MolecularWeight: 458.6183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

InChI

InChI=1S/C27H30N4OS/c1-19(2)16-20-5-8-22(9-6-20)26(24-4-3-15-33-24)30-27(32)23-11-13-31(14-12-23)25-10-7-21(17-28)18-29-25/h3-10,15,18-19,23,26H,11-14,16H2,1-2H3,(H,30,32)