ethyl 5-methyl-4-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-[4-(pyrimidin-2-ylsulfamoyl)anilino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[4-(2-pyrimidinylsulfamoyl)anilino]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-[4-(pyrimidin-2-ylsulfamoyl)anilino]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-[4-(2-pyrimidylsulfamoyl)anilino]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H18N6O4S2 MolecularWeight: 470.52472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)C

InChI

InChI=1S/C20H18N6O4S2/c1-3-30-19(27)16-12(2)15-17(23-11-24-18(15)31-16)25-13-5-7-14(8-6-13)32(28,29)26-20-21-9-4-10-22-20/h4-11H,3H2,1-2H3,(H,21,22,26)(H,23,24,25)