propan-2-yl 5-cyano-2-methyl-6-[4-(naphthalen-2-ylsulfonylcarbamoyl)piperidin-1-yl]pyridine-3-carboxylate

Systemtic Name: propan-2-yl 5-cyano-2-methyl-6-[4-(naphthalen-2-ylsulfonylcarbamoyl)piperidin-1-yl]pyridine-3-carboxylate Openeye Name: isopropyl 5-cyano-2-methyl-6-[4-(2-naphthylsulfonylcarbamoyl)-1-piperidyl]pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[4-[(2-naphthalenylsulfonylamino)-oxomethyl]-1-piperidinyl]-3-pyridinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-cyano-2-methyl-6-[4-(naphthalen-2-ylsulfonylcarbamoyl)piperidin-1-yl]pyridine-3-carboxylate Traditional Name: 5-cyano-2-methyl-6-[4-(2-naphthylsulfonylcarbamoyl)piperidino]nicotinic acid isopropyl ester Formula: C27H28N4O5S MolecularWeight: 520.60002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)N2CCC(CC2)C(=O)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C#N)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C=C(C(=N1)N2CCC(CC2)C(=O)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C#N)C(=O)OC(C)C

InChI

InChI=1S/C27H28N4O5S/c1-17(2)36-27(33)24-15-22(16-28)25(29-18(24)3)31-12-10-20(11-13-31)26(32)30-37(34,35)23-9-8-19-6-4-5-7-21(19)14-23/h4-9,14-15,17,20H,10-13H2,1-3H3,(H,30,32)