(3-methylphenyl) 3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: (3-methylphenyl) 3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: m-tolyl 3,5-dimethyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3,5-dimethyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 3,5-dimethyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid m-tolyl ester Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)C2=C(C3=C(S2)N=CN(C3=O)C)C

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)C2=C(C3=C(S2)N=CN(C3=O)C)C

InChI

InChI=1S/C16H14N2O3S/c1-9-5-4-6-11(7-9)21-16(20)13-10(2)12-14(22-13)17-8-18(3)15(12)19/h4-8H,1-3H3