(2S)-2-(dibenzothiophen-2-ylsulfonylamino)-3-methyl-butanoic acid

Systemtic Name: (2S)-2-(dibenzothiophen-2-ylsulfonylamino)-3-methyl-butanoic acid Openeye Name: (2S)-2-(dibenzothiophen-2-ylsulfonylamino)-3-methyl-butanoic acid CAS Name: (2S)-2-(2-dibenzothiophenylsulfonylamino)-3-methylbutanoic acid IUPAC Name: (2S)-2-(dibenzothiophen-2-ylsulfonylamino)-3-methylbutanoic acid Traditional Name: (2S)-2-(dibenzothiophen-2-ylsulfonylamino)-3-methyl-butyric acid Formula: C17H17NO4S2 MolecularWeight: 363.45118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)SC3=CC=CC=C32

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)SC3=CC=CC=C32

InChI

InChI=1S/C17H17NO4S2/c1-10(2)16(17(19)20)18-24(21,22)11-7-8-15-13(9-11)12-5-3-4-6-14(12)23-15/h3-10,16,18H,1-2H3,(H,19,20)/t16-/m0/s1