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

Systemtic Name: methyl 5-[(4-chlorophenyl)carbonyl-(4-ethylphenyl)sulfonyl-amino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: methyl 5-[(4-chlorobenzoyl)-(4-ethylphenyl)sulfonyl-amino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[[(4-chlorophenyl)-oxomethyl]-(4-ethylphenyl)sulfonylamino]-2-methyl-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-chlorobenzoyl)-(4-ethylphenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-chlorobenzoyl)-(4-ethylphenyl)sulfonyl-amino]-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C26H22ClNO6S MolecularWeight: 511.97398

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=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

CCC1=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/C26H22ClNO6S/c1-4-17-5-12-21(13-6-17)35(31,32)28(25(29)18-7-9-19(27)10-8-18)20-11-14-23-22(15-20)24(16(2)34-23)26(30)33-3/h5-15H,4H2,1-3H3