(4-methylsulfanylphenyl)methyl 3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: (4-methylsulfanylphenyl)methyl 3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: (4-methylsulfanylphenyl)methyl 3,5-dimethyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3,5-dimethyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 3,5-dimethyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid [4-(methylthio)benzyl] ester Formula: C17H16N2O3S2 MolecularWeight: 360.45054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)OCC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)OCC3=CC=C(C=C3)SC

InChI

InChI=1S/C17H16N2O3S2/c1-10-13-15(18-9-19(2)16(13)20)24-14(10)17(21)22-8-11-4-6-12(23-3)7-5-11/h4-7,9H,8H2,1-3H3