ethyl 6-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5-cyano-2-methyl-4-phenyl-pyridine-3-carboxylate

Systemtic Name: ethyl 6-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5-cyano-2-methyl-4-phenyl-pyridine-3-carboxylate Openeye Name: ethyl 6-(2-amino-2-oxo-ethyl)sulfanyl-5-cyano-2-methyl-4-phenyl-pyridine-3-carboxylate CAS Name: 6-[(2-amino-2-oxoethyl)thio]-5-cyano-2-methyl-4-phenyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-2-methyl-4-phenylpyridine-3-carboxylate Traditional Name: 6-[(2-amino-2-keto-ethyl)thio]-5-cyano-2-methyl-4-phenyl-nicotinic acid ethyl ester Formula: C18H17N3O3S MolecularWeight: 355.41088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1C2=CC=CC=C2)C#N)SCC(=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1C2=CC=CC=C2)C#N)SCC(=O)N)C

InChI

InChI=1S/C18H17N3O3S/c1-3-24-18(23)15-11(2)21-17(25-10-14(20)22)13(9-19)16(15)12-7-5-4-6-8-12/h4-8H,3,10H2,1-2H3,(H2,20,22)