ethyl 4-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)benzoate

Systemtic Name: ethyl 4-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)benzoate Openeye Name: ethyl 4-(4-oxo-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)benzoate CAS Name: 4-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)benzoate Traditional Name: 4-(4-keto-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)benzoic acid ethyl ester Formula: C15H12N2O3S2 MolecularWeight: 332.39738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C=CS3)NC2=S

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C=CS3)NC2=S

InChI

InChI=1S/C15H12N2O3S2/c1-2-20-14(19)9-3-5-10(6-4-9)17-13(18)12-11(7-8-22-12)16-15(17)21/h3-8H,2H2,1H3,(H,16,21)