methyl 2-(4-oxidanylidene-3,5-diphenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanoate

Systemtic Name: methyl 2-(4-oxidanylidene-3,5-diphenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanoate Openeye Name: methyl 2-(4-oxo-3,5-diphenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(4-oxo-3,5-diphenyl-2-thieno[2,3-d]pyrimidinyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(4-oxo-3,5-diphenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(4-keto-3,5-diphenyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetic acid methyl ester Formula: C21H16N2O3S2 MolecularWeight: 408.49334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1C4=CC=CC=C4

Isomeric SMILES

COC(=O)CSC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1C4=CC=CC=C4

InChI

InChI=1S/C21H16N2O3S2/c1-26-17(24)13-28-21-22-19-18(16(12-27-19)14-8-4-2-5-9-14)20(25)23(21)15-10-6-3-7-11-15/h2-12H,13H2,1H3