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

Systemtic Name: ethyl 2-methyl-5-[(4-methylphenyl)carbonyl-(4-methylphenyl)sulfonyl-amino]-1-benzofuran-3-carboxylate Openeye Name: ethyl 2-methyl-5-[(4-methylbenzoyl)-(p-tolylsulfonyl)amino]benzofuran-3-carboxylate CAS Name: 2-methyl-5-[[(4-methylphenyl)-oxomethyl]-(4-methylphenyl)sulfonylamino]-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-5-[(4-methylbenzoyl)-(4-methylphenyl)sulfonylamino]-1-benzofuran-3-carboxylate Traditional Name: 2-methyl-5-[p-toluoyl(tosyl)amino]benzofuran-3-carboxylic acid ethyl ester Formula: C27H25NO6S MolecularWeight: 491.5555

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25NO6S/c1-5-33-27(30)25-19(4)34-24-15-12-21(16-23(24)25)28(26(29)20-10-6-17(2)7-11-20)35(31,32)22-13-8-18(3)9-14-22/h6-16H,5H2,1-4H3