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

Systemtic Name: ethyl 5-[(4-methylphenyl)carbonyl-(4-methylphenyl)sulfonyl-amino]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[(4-methylbenzoyl)-(p-tolylsulfonyl)amino]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[[(4-methylphenyl)-oxomethyl]-(4-methylphenyl)sulfonylamino]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-methylbenzoyl)-(4-methylphenyl)sulfonylamino]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 2-phenyl-5-[p-toluoyl(tosyl)amino]benzofuran-3-carboxylic acid ethyl ester Formula: C32H27NO6S MolecularWeight: 553.62488

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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)C5=CC=CC=C5

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)C5=CC=CC=C5

InChI

InChI=1S/C32H27NO6S/c1-4-38-32(35)29-27-20-25(16-19-28(27)39-30(29)23-8-6-5-7-9-23)33(31(34)24-14-10-21(2)11-15-24)40(36,37)26-17-12-22(3)13-18-26/h5-20H,4H2,1-3H3