methyl 2-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanoate Openeye Name: methyl 2-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[3-(3,4-dimethylphenyl)-5-ethyl-4-keto-6-methyl-thieno[2,3-d]pyrimidin-2-yl]thio]acetic acid methyl ester Formula: C20H22N2O3S2 MolecularWeight: 402.53028

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)OC)C3=CC(=C(C=C3)C)C)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)OC)C3=CC(=C(C=C3)C)C)C

InChI

InChI=1S/C20H22N2O3S2/c1-6-15-13(4)27-18-17(15)19(24)22(14-8-7-11(2)12(3)9-14)20(21-18)26-10-16(23)25-5/h7-9H,6,10H2,1-5H3