methyl 2-methyl-5-[(4-methylphenyl)sulfonyl-pyridin-4-ylcarbonyl-amino]-1-benzofuran-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[(4-methylphenyl)sulfonyl-pyridin-4-ylcarbonyl-amino]-1-benzofuran-3-carboxylate Openeye Name: methyl 2-methyl-5-[p-tolylsulfonyl(pyridine-4-carbonyl)amino]benzofuran-3-carboxylate CAS Name: 2-methyl-5-[(4-methylphenyl)sulfonyl-[oxo(pyridin-4-yl)methyl]amino]-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[(4-methylphenyl)sulfonyl-(pyridine-4-carbonyl)amino]-1-benzofuran-3-carboxylate Traditional Name: 5-[isonicotinoyl(tosyl)amino]-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C24H20N2O6S MolecularWeight: 464.4904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)OC)C)C(=O)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)OC)C)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C24H20N2O6S/c1-15-4-7-19(8-5-15)33(29,30)26(23(27)17-10-12-25-13-11-17)18-6-9-21-20(14-18)22(16(2)32-21)24(28)31-3/h4-14H,1-3H3