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

Systemtic Name: ethyl 4-(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)benzoate Openeye Name: ethyl 4-(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)benzoate CAS Name: 4-(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)benzoate Traditional Name: 4-(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-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)C2=NC3=C(C(=C(S3)C)C)C(=O)N2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=NC3=C(C(=C(S3)C)C)C(=O)N2

InChI

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