ethyl 5-methyl-4-oxidanylidene-2-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonyloxymethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-2-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonyloxymethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-oxo-2-(4,5,6,7-tetrahydrobenzothiophene-2-carbonyloxymethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methoxy]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-2-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyloxymethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-(4,5,6,7-tetrahydrobenzothiophene-2-carbonyloxymethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H20N2O5S2 MolecularWeight: 432.5132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)COC(=O)C3=CC4=C(S3)CCCC4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)COC(=O)C3=CC4=C(S3)CCCC4)C

InChI

InChI=1S/C20H20N2O5S2/c1-3-26-20(25)16-10(2)15-17(23)21-14(22-18(15)29-16)9-27-19(24)13-8-11-6-4-5-7-12(11)28-13/h8H,3-7,9H2,1-2H3,(H,21,22,23)