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

Systemtic Name: methyl 5-[(4-chlorophenyl)carbonyl-(4-methylphenyl)sulfonyl-amino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: methyl 5-[(4-chlorobenzoyl)-(p-tolylsulfonyl)amino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[[(4-chlorophenyl)-oxomethyl]-(4-methylphenyl)sulfonylamino]-2-methyl-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-chlorobenzoyl)-(4-methylphenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-chlorobenzoyl)-tosyl-amino]-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C25H20ClNO6S MolecularWeight: 497.9474

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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=C(C=C4)Cl

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=C(C=C4)Cl

InChI

InChI=1S/C25H20ClNO6S/c1-15-4-11-20(12-5-15)34(30,31)27(24(28)17-6-8-18(26)9-7-17)19-10-13-22-21(14-19)23(16(2)33-22)25(29)32-3/h4-14H,1-3H3