ethyl 4-azanyl-5-methyl-2-[2-(thiophen-2-ylsulfonylamino)ethanoyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-azanyl-5-methyl-2-[2-(thiophen-2-ylsulfonylamino)ethanoyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-5-methyl-2-[[2-(2-thienylsulfonylamino)acetyl]oxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-5-methyl-2-[[1-oxo-2-(thiophen-2-ylsulfonylamino)ethoxy]methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-5-methyl-2-[[2-(thiophen-2-ylsulfonylamino)acetyl]oxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-5-methyl-2-[[2-(2-thienylsulfonylamino)acetyl]oxymethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C17H18N4O6S3 MolecularWeight: 470.54302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)CNS(=O)(=O)C3=CC=CS3)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)CNS(=O)(=O)C3=CC=CS3)N)C

InChI

InChI=1S/C17H18N4O6S3/c1-3-26-17(23)14-9(2)13-15(18)20-10(21-16(13)29-14)8-27-11(22)7-19-30(24,25)12-5-4-6-28-12/h4-6,19H,3,7-8H2,1-2H3,(H2,18,20,21)