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

Systemtic Name: propan-2-yl 5-methyl-4-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C21H20N6O4S2 MolecularWeight: 484.5513

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)C(=O)OC(C)C

InChI

InChI=1S/C21H20N6O4S2/c1-12(2)31-20(28)17-13(3)16-18(24-11-25-19(16)32-17)26-14-5-7-15(8-6-14)33(29,30)27-21-22-9-4-10-23-21/h4-12H,1-3H3,(H,22,23,27)(H,24,25,26)