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

Systemtic Name: methyl 3-[(3-ethyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 3-[(3-ethyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 3-[[(3-ethyl-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 3-[(3-ethyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 3-[[(3-ethyl-4-keto-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C21H18N2O4S2 MolecularWeight: 426.50862

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCC3=C(OC=C3)C(=O)OC)SC=C2C4=CC=CC=C4

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCC3=C(OC=C3)C(=O)OC)SC=C2C4=CC=CC=C4

InChI

InChI=1S/C21H18N2O4S2/c1-3-23-19(24)16-15(13-7-5-4-6-8-13)12-28-18(16)22-21(23)29-11-14-9-10-27-17(14)20(25)26-2/h4-10,12H,3,11H2,1-2H3