ethyl 4-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-[4-methoxy-3-(1-piperidylsulfonyl)anilino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[4-methoxy-3-(1-piperidinylsulfonyl)anilino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxy-3-piperidin-1-ylsulfonylanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(4-methoxy-3-piperidinosulfonyl-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H26N4O5S2 MolecularWeight: 490.59564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCCC4)C

InChI

InChI=1S/C22H26N4O5S2/c1-4-31-22(27)19-14(2)18-20(23-13-24-21(18)32-19)25-15-8-9-16(30-3)17(12-15)33(28,29)26-10-6-5-7-11-26/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,23,24,25)