methyl 3-[(3-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 3-[(3-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 3-[(3-methyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 3-[[(3-methyl-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 3-[(3-methyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 3-[[(4-keto-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C20H16N2O4S2 MolecularWeight: 412.48204

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC3=C(OC=C3)C(=O)OC)SC=C2C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC3=C(OC=C3)C(=O)OC)SC=C2C4=CC=CC=C4

InChI

InChI=1S/C20H16N2O4S2/c1-22-18(23)15-14(12-6-4-3-5-7-12)11-27-17(15)21-20(22)28-10-13-8-9-26-16(13)19(24)25-2/h3-9,11H,10H2,1-2H3