ethyl 2-(4-chlorophenyl)-5-methyl-4-oxidanylidene-1H-thieno[3,4-d]pyrimidine-7-carboxylate

Systemtic Name: ethyl 2-(4-chlorophenyl)-5-methyl-4-oxidanylidene-1H-thieno[3,4-d]pyrimidine-7-carboxylate Openeye Name: ethyl 2-(4-chlorophenyl)-5-methyl-4-oxo-1H-thieno[3,4-d]pyrimidine-7-carboxylate CAS Name: 2-(4-chlorophenyl)-5-methyl-4-oxo-1H-thieno[3,4-d]pyrimidine-7-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chlorophenyl)-5-methyl-4-oxo-1H-thieno[3,4-d]pyrimidine-7-carboxylate Traditional Name: 2-(4-chlorophenyl)-4-keto-5-methyl-1H-thieno[3,4-d]pyrimidine-7-carboxylic acid ethyl ester Formula: C16H13ClN2O3S MolecularWeight: 348.80402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=C(S1)C)C(=O)N=C(N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C2C(=C(S1)C)C(=O)N=C(N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2O3S/c1-3-22-16(21)13-12-11(8(2)23-13)15(20)19-14(18-12)9-4-6-10(17)7-5-9/h4-7H,3H2,1-2H3,(H,18,19,20)