phenyl 3-ethyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: phenyl 3-ethyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenyl 3-ethyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-ethyl-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid phenyl ester IUPAC Name: phenyl 3-ethyl-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-ethyl-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid phenyl ester Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C(C1=O)C(=C(S2)C(=O)OC3=CC=CC=C3)C

Isomeric SMILES

CCN1C=NC2=C(C1=O)C(=C(S2)C(=O)OC3=CC=CC=C3)C

InChI

InChI=1S/C16H14N2O3S/c1-3-18-9-17-14-12(15(18)19)10(2)13(22-14)16(20)21-11-7-5-4-6-8-11/h4-9H,3H2,1-2H3