tert-butyl (2S)-3-methyl-2-[[7-(methylsulfonylamino)dibenzothiophen-2-yl]sulfonylamino]butanoate

Systemtic Name: tert-butyl (2S)-3-methyl-2-[[7-(methylsulfonylamino)dibenzothiophen-2-yl]sulfonylamino]butanoate Openeye Name: tert-butyl (2S)-2-[[7-(methanesulfonamido)dibenzothiophen-2-yl]sulfonylamino]-3-methyl-butanoate CAS Name: (2S)-2-[[7-(methanesulfonamido)-2-dibenzothiophenyl]sulfonylamino]-3-methylbutanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[7-(methanesulfonamido)dibenzothiophen-2-yl]sulfonylamino]-3-methylbutanoate Traditional Name: (2S)-2-[[7-(methanesulfonamido)dibenzothiophen-2-yl]sulfonylamino]-3-methyl-butyric acid tert-butyl ester Formula: C22H28N2O6S3 MolecularWeight: 512.66252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)(C)C)NS(=O)(=O)C1=CC2=C(C=C1)SC3=C2C=CC(=C3)NS(=O)(=O)C

Isomeric SMILES

CC(C)[C@@H](C(=O)OC(C)(C)C)NS(=O)(=O)C1=CC2=C(C=C1)SC3=C2C=CC(=C3)NS(=O)(=O)C

InChI

InChI=1S/C22H28N2O6S3/c1-13(2)20(21(25)30-22(3,4)5)24-33(28,29)15-8-10-18-17(12-15)16-9-7-14(11-19(16)31-18)23-32(6,26)27/h7-13,20,23-24H,1-6H3/t20-/m0/s1