5-cyano-6-methyl-2-oxidanylidene-4-(4-phenyl-1,3-thiazol-5-yl)-1,4-dihydropyrimidine-3-carboxylic acid

Systemtic Name: 5-cyano-6-methyl-2-oxidanylidene-4-(4-phenyl-1,3-thiazol-5-yl)-1,4-dihydropyrimidine-3-carboxylic acid Openeye Name: 5-cyano-6-methyl-2-oxo-4-(4-phenylthiazol-5-yl)-1,4-dihydropyrimidine-3-carboxylic acid CAS Name: 5-cyano-6-methyl-2-oxo-4-(4-phenyl-5-thiazolyl)-1,4-dihydropyrimidine-3-carboxylic acid IUPAC Name: 5-cyano-6-methyl-2-oxo-4-(4-phenyl-1,3-thiazol-5-yl)-1,4-dihydropyrimidine-3-carboxylic acid Traditional Name: 5-cyano-2-keto-6-methyl-4-(4-phenylthiazol-5-yl)-1,4-dihydropyrimidine-3-carboxylic acid Formula: C16H12N4O3S MolecularWeight: 340.35648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)C(=O)O)C2=C(N=CS2)C3=CC=CC=C3)C#N

Isomeric SMILES

CC1=C(C(N(C(=O)N1)C(=O)O)C2=C(N=CS2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C16H12N4O3S/c1-9-11(7-17)13(20(16(22)23)15(21)19-9)14-12(18-8-24-14)10-5-3-2-4-6-10/h2-6,8,13H,1H3,(H,19,21)(H,22,23)