methyl 2-[(3-cyclopentyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylate

Systemtic Name: methyl 2-[(3-cyclopentyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylate Openeye Name: methyl 2-[(3-cyclopentyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylate CAS Name: 2-[[(3-cyclopentyl-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-cyclopentyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylate Traditional Name: 2-[[(3-cyclopentyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]furan-3-carboxylic acid methyl ester Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=C(C=CO3)C(=O)OC)C4CCCC4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=C(C=CO3)C(=O)OC)C4CCCC4)C

InChI

InChI=1S/C20H22N2O4S2/c1-11-12(2)28-17-16(11)18(23)22(13-6-4-5-7-13)20(21-17)27-10-15-14(8-9-26-15)19(24)25-3/h8-9,13H,4-7,10H2,1-3H3