ethyl 2-phenyl-5-[pyridin-4-ylcarbonyl-(2,4,6-trimethylphenyl)sulfonyl-amino]-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 2-phenyl-5-[pyridin-4-ylcarbonyl-(2,4,6-trimethylphenyl)sulfonyl-amino]-1-benzofuran-3-carboxylate Openeye Name: ethyl 2-phenyl-5-[pyridine-4-carbonyl-(2,4,6-trimethylphenyl)sulfonyl-amino]benzofuran-3-carboxylate CAS Name: 5-[[oxo(pyridin-4-yl)methyl]-(2,4,6-trimethylphenyl)sulfonylamino]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-phenyl-5-[pyridine-4-carbonyl-(2,4,6-trimethylphenyl)sulfonylamino]-1-benzofuran-3-carboxylate Traditional Name: 5-[isonicotinoyl(mesitylsulfonyl)amino]-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C32H28N2O6S MolecularWeight: 568.63952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(C(=O)C3=CC=NC=C3)S(=O)(=O)C4=C(C=C(C=C4C)C)C)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(C(=O)C3=CC=NC=C3)S(=O)(=O)C4=C(C=C(C=C4C)C)C)C5=CC=CC=C5

InChI

InChI=1S/C32H28N2O6S/c1-5-39-32(36)28-26-19-25(11-12-27(26)40-29(28)23-9-7-6-8-10-23)34(31(35)24-13-15-33-16-14-24)41(37,38)30-21(3)17-20(2)18-22(30)4/h6-19H,5H2,1-4H3