N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidyl]-3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidinyl]-3-cyano-6-cyclopropyl-2-(methylthio)-4-pyridinecarboxamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-3-cyano-6-cyclopropyl-2-methylsulfanylpyridine-4-carboxamide Traditional Name: N-[1-(4-chlorobenzyl)-4-piperidyl]-3-cyano-6-cyclopropyl-2-(methylthio)isonicotinamide Formula: C23H25ClN4OS MolecularWeight: 440.9888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=CC(=N1)C2CC2)C(=O)NC3CCN(CC3)CC4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

CSC1=C(C(=CC(=N1)C2CC2)C(=O)NC3CCN(CC3)CC4=CC=C(C=C4)Cl)C#N

InChI

InChI=1S/C23H25ClN4OS/c1-30-23-20(13-25)19(12-21(27-23)16-4-5-16)22(29)26-18-8-10-28(11-9-18)14-15-2-6-17(24)7-3-15/h2-3,6-7,12,16,18H,4-5,8-11,14H2,1H3,(H,26,29)