ethyl 4-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)benzoate

Systemtic Name: ethyl 4-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)benzoate Openeye Name: ethyl 4-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)benzoate CAS Name: 4-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)benzoate Traditional Name: 4-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)benzoic acid ethyl ester Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C=NC3=C(C2=O)C(=C(S3)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C=NC3=C(C2=O)C(=C(S3)C)C

InChI

InChI=1S/C17H16N2O3S/c1-4-22-17(21)12-5-7-13(8-6-12)19-9-18-15-14(16(19)20)10(2)11(3)23-15/h5-9H,4H2,1-3H3