ethyl 5-cyano-6-methyl-2-oxidanylidene-4-(3-thiophen-2-ylphenyl)-1,4-dihydropyrimidine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-methyl-2-oxidanylidene-4-(3-thiophen-2-ylphenyl)-1,4-dihydropyrimidine-3-carboxylate Openeye Name: ethyl 5-cyano-6-methyl-2-oxo-4-[3-(2-thienyl)phenyl]-1,4-dihydropyrimidine-3-carboxylate CAS Name: 5-cyano-6-methyl-2-oxo-4-(3-thiophen-2-ylphenyl)-1,4-dihydropyrimidine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-methyl-2-oxo-4-(3-thiophen-2-ylphenyl)-1,4-dihydropyrimidine-3-carboxylate Traditional Name: 5-cyano-2-keto-6-methyl-4-[3-(2-thienyl)phenyl]-1,4-dihydropyrimidine-3-carboxylic acid ethyl ester Formula: C19H17N3O3S MolecularWeight: 367.42158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(C(=C(NC1=O)C)C#N)C2=CC=CC(=C2)C3=CC=CS3

Isomeric SMILES

CCOC(=O)N1C(C(=C(NC1=O)C)C#N)C2=CC=CC(=C2)C3=CC=CS3

InChI

InChI=1S/C19H17N3O3S/c1-3-25-19(24)22-17(15(11-20)12(2)21-18(22)23)14-7-4-6-13(10-14)16-8-5-9-26-16/h4-10,17H,3H2,1-2H3,(H,21,23)