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

Systemtic Name: methyl 5-[(4-tert-butylphenyl)sulfonyl-(4-methylphenyl)carbonyl-amino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: methyl 5-[(4-tert-butylphenyl)sulfonyl-(4-methylbenzoyl)amino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[(4-tert-butylphenyl)sulfonyl-[(4-methylphenyl)-oxomethyl]amino]-2-methyl-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-tert-butylphenyl)sulfonyl-(4-methylbenzoyl)amino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-tert-butylphenyl)sulfonyl-p-toluoyl-amino]-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C29H29NO6S MolecularWeight: 519.60866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H29NO6S/c1-18-7-9-20(10-8-18)27(31)30(37(33,34)23-14-11-21(12-15-23)29(3,4)5)22-13-16-25-24(17-22)26(19(2)36-25)28(32)35-6/h7-17H,1-6H3