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

Systemtic Name: ethyl 5-methyl-4-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methylamino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-[[2-(isopropylsulfamoylmethyl)phenyl]methylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methylamino]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methylamino]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[[2-(isopropylsulfamoylmethyl)benzyl]amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H26N4O4S2 MolecularWeight: 462.58554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCC3=CC=CC=C3CS(=O)(=O)NC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCC3=CC=CC=C3CS(=O)(=O)NC(C)C)C

InChI

InChI=1S/C21H26N4O4S2/c1-5-29-21(26)18-14(4)17-19(23-12-24-20(17)30-18)22-10-15-8-6-7-9-16(15)11-31(27,28)25-13(2)3/h6-9,12-13,25H,5,10-11H2,1-4H3,(H,22,23,24)