methyl 4-[(5-ethylsulfonyl-2-oxidanyl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 4-[(5-ethylsulfonyl-2-oxidanyl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 4-(5-ethylsulfonyl-2-hydroxy-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(5-ethylsulfonyl-2-hydroxyanilino)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(5-ethylsulfonyl-2-hydroxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(5-esyl-2-hydroxy-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C17H17N3O5S2 MolecularWeight: 407.46398

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC2=C3C(=C(SC3=NC=N2)C(=O)OC)C

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC2=C3C(=C(SC3=NC=N2)C(=O)OC)C

InChI

InChI=1S/C17H17N3O5S2/c1-4-27(23,24)10-5-6-12(21)11(7-10)20-15-13-9(2)14(17(22)25-3)26-16(13)19-8-18-15/h5-8,21H,4H2,1-3H3,(H,18,19,20)