ethyl 5-cyano-6-[2-(cyclopentylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[2-(cyclopentylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-(cyclopentylcarbamoylamino)-2-oxo-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-[[(cyclopentylamino)-oxomethyl]amino]-2-oxoethyl]thio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[2-(cyclopentylcarbamoylamino)-2-oxoethyl]sulfanyl-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-(cyclopentylcarbamoylamino)-2-keto-ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C18H22N4O4S MolecularWeight: 390.45668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NC(=O)NC2CCCC2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NC(=O)NC2CCCC2)C

InChI

InChI=1S/C18H22N4O4S/c1-3-26-17(24)14-8-12(9-19)16(20-11(14)2)27-10-15(23)22-18(25)21-13-6-4-5-7-13/h8,13H,3-7,10H2,1-2H3,(H2,21,22,23,25)