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

Systemtic Name: diethyl (2S)-2-[[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylamino]pentanedioate Openeye Name: diethyl (2S)-2-[[4-[methyl(p-tolylsulfonyl)amino]benzoyl]amino]pentanedioate CAS Name: (2S)-2-[[[4-[methyl-(4-methylphenyl)sulfonylamino]phenyl]-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl (2S)-2-[[4-[methyl-(4-methylphenyl)sulfonylamino]benzoyl]amino]pentanedioate Traditional Name: (2S)-2-[[4-[methyl(tosyl)amino]benzoyl]amino]glutaric acid diethyl ester Formula: C24H30N2O7S MolecularWeight: 490.5692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C24H30N2O7S/c1-5-32-22(27)16-15-21(24(29)33-6-2)25-23(28)18-9-11-19(12-10-18)26(4)34(30,31)20-13-7-17(3)8-14-20/h7-14,21H,5-6,15-16H2,1-4H3,(H,25,28)/t21-/m0/s1