ethyl 2-[[3-[(4-acetamidophenyl)sulfonylamino]quinoxalin-2-yl]amino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[3-[(4-acetamidophenyl)sulfonylamino]quinoxalin-2-yl]amino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[3-[(4-acetamidophenyl)sulfonylamino]quinoxalin-2-yl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[3-[(4-acetamidophenyl)sulfonylamino]-2-quinoxalinyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-[(4-acetamidophenyl)sulfonylamino]quinoxalin-2-yl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[3-[(4-acetamidophenyl)sulfonylamino]quinoxalin-2-yl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H25N5O5S2 MolecularWeight: 539.6265

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C25H25N5O5S2/c1-5-35-25(32)21-14(2)15(3)36-24(21)29-22-23(28-20-9-7-6-8-19(20)27-22)30-37(33,34)18-12-10-17(11-13-18)26-16(4)31/h6-13H,5H2,1-4H3,(H,26,31)(H,27,29)(H,28,30)