4-[5-(4-chlorophenyl)-1,3-oxazol-4-yl]-5-cyano-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylic acid

Systemtic Name: 4-[5-(4-chlorophenyl)-1,3-oxazol-4-yl]-5-cyano-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylic acid Openeye Name: 4-[5-(4-chlorophenyl)oxazol-4-yl]-5-cyano-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylic acid CAS Name: 4-[5-(4-chlorophenyl)-4-oxazolyl]-5-cyano-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylic acid IUPAC Name: 4-[5-(4-chlorophenyl)-1,3-oxazol-4-yl]-5-cyano-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylic acid Traditional Name: 4-[5-(4-chlorophenyl)oxazol-4-yl]-5-cyano-2-keto-6-methyl-1,4-dihydropyrimidine-3-carboxylic acid Formula: C16H11ClN4O4 MolecularWeight: 358.73594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)C(=O)O)C2=C(OC=N2)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CC1=C(C(N(C(=O)N1)C(=O)O)C2=C(OC=N2)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C16H11ClN4O4/c1-8-11(6-18)13(21(16(23)24)15(22)20-8)12-14(25-7-19-12)9-2-4-10(17)5-3-9/h2-5,7,13H,1H3,(H,20,22)(H,23,24)