ethyl 4,6-dimethyl-3-[(3-methylsulfonylphenyl)carbonylamino]thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 4,6-dimethyl-3-[(3-methylsulfonylphenyl)carbonylamino]thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 4,6-dimethyl-3-[(3-methylsulfonylbenzoyl)amino]thieno[2,3-b]pyridine-2-carboxylate CAS Name: 4,6-dimethyl-3-[[(3-methylsulfonylphenyl)-oxomethyl]amino]-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4,6-dimethyl-3-[(3-methylsulfonylbenzoyl)amino]thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-[(3-mesylbenzoyl)amino]-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C20H20N2O5S2 MolecularWeight: 432.5132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(C=C2C)C)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(C=C2C)C)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C20H20N2O5S2/c1-5-27-20(24)17-16(15-11(2)9-12(3)21-19(15)28-17)22-18(23)13-7-6-8-14(10-13)29(4,25)26/h6-10H,5H2,1-4H3,(H,22,23)