diethyl 2-[[4-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]phenyl]carbonylamino]pentanedioate

Systemtic Name: diethyl 2-[[4-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]phenyl]carbonylamino]pentanedioate Openeye Name: diethyl 2-[[4-[benzyl(p-tolylsulfonyl)amino]benzoyl]amino]pentanedioate CAS Name: 2-[[[4-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]phenyl]-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-[benzyl-(4-methylphenyl)sulfonylamino]benzoyl]amino]pentanedioate Traditional Name: 2-[[4-[benzyl(tosyl)amino]benzoyl]amino]glutaric acid diethyl ester Formula: C30H34N2O7S MolecularWeight: 566.66516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)N(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)N(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C30H34N2O7S/c1-4-38-28(33)20-19-27(30(35)39-5-2)31-29(34)24-13-15-25(16-14-24)32(21-23-9-7-6-8-10-23)40(36,37)26-17-11-22(3)12-18-26/h6-18,27H,4-5,19-21H2,1-3H3,(H,31,34)