ethyl 5-methyl-4-[[4-(methylsulfamoylmethyl)phenyl]methylamino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-[[4-(methylsulfamoylmethyl)phenyl]methylamino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-[[4-(methylsulfamoylmethyl)phenyl]methylamino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[[4-(methylsulfamoylmethyl)phenyl]methylamino]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-[[4-(methylsulfamoylmethyl)phenyl]methylamino]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-[[4-(methylsulfamoylmethyl)benzyl]amino]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H22N4O4S2 MolecularWeight: 434.53238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCC3=CC=C(C=C3)CS(=O)(=O)NC)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCC3=CC=C(C=C3)CS(=O)(=O)NC)C

InChI

InChI=1S/C19H22N4O4S2/c1-4-27-19(24)16-12(2)15-17(22-11-23-18(15)28-16)21-9-13-5-7-14(8-6-13)10-29(25,26)20-3/h5-8,11,20H,4,9-10H2,1-3H3,(H,21,22,23)