tert-butyl (2R)-3-methyl-2-[[4-[(4-methylsulfanylphenyl)carbonylamino]phenyl]sulfonylamino]butanoate

Systemtic Name: tert-butyl (2R)-3-methyl-2-[[4-[(4-methylsulfanylphenyl)carbonylamino]phenyl]sulfonylamino]butanoate Openeye Name: tert-butyl (2R)-3-methyl-2-[[4-[(4-methylsulfanylbenzoyl)amino]phenyl]sulfonylamino]butanoate CAS Name: (2R)-3-methyl-2-[[4-[[[4-(methylthio)phenyl]-oxomethyl]amino]phenyl]sulfonylamino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-3-methyl-2-[[4-[(4-methylsulfanylbenzoyl)amino]phenyl]sulfonylamino]butanoate Traditional Name: (2R)-3-methyl-2-[[4-[[4-(methylthio)benzoyl]amino]phenyl]sulfonylamino]butyric acid tert-butyl ester Formula: C23H30N2O5S2 MolecularWeight: 478.6247

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)(C)C)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CC(C)[C@H](C(=O)OC(C)(C)C)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C23H30N2O5S2/c1-15(2)20(22(27)30-23(3,4)5)25-32(28,29)19-13-9-17(10-14-19)24-21(26)16-7-11-18(31-6)12-8-16/h7-15,20,25H,1-6H3,(H,24,26)/t20-/m1/s1