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2-methylpropyl 4-[(5-ethylsulfonyl-2-oxidanyl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

2-methylpropyl 4-[(5-ethylsulfonyl-2-oxidanyl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name:2-methylpropyl 4-[(5-ethylsulfonyl-2-oxidanyl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate
Openeye Name:isobutyl 4-(5-ethylsulfonyl-2-hydroxy-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name:4-(5-ethylsulfonyl-2-hydroxyanilino)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid 2-methylpropyl ester
IUPAC Name:2-methylpropyl 4-(5-ethylsulfonyl-2-hydroxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
Traditional Name:4-(5-esyl-2-hydroxy-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid isobutyl ester
Formula: C20H23N3O5S2
MolecularWeight: 449.54372
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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC2=C3C(=C(SC3=NC=N2)C(=O)OCC(C)C)C


Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC2=C3C(=C(SC3=NC=N2)C(=O)OCC(C)C)C


InChI

InChI=1S/C20H23N3O5S2/c1-5-30(26,27)13-6-7-15(24)14(8-13)23-18-16-12(4)17(20(25)28-9-11(2)3)29-19(16)22-10-21-18/h6-8,10-11,24H,5,9H2,1-4H3,(H,21,22,23)


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