tert-butyl (2S)-2-(1,3-benzothiazol-2-ylsulfonylamino)-3-methyl-butanoate

Systemtic Name: tert-butyl (2S)-2-(1,3-benzothiazol-2-ylsulfonylamino)-3-methyl-butanoate Openeye Name: tert-butyl (2S)-2-(1,3-benzothiazol-2-ylsulfonylamino)-3-methyl-butanoate CAS Name: (2S)-2-(1,3-benzothiazol-2-ylsulfonylamino)-3-methylbutanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-(1,3-benzothiazol-2-ylsulfonylamino)-3-methylbutanoate Traditional Name: (2S)-2-(1,3-benzothiazol-2-ylsulfonylamino)-3-methyl-butyric acid tert-butyl ester Formula: C16H22N2O4S2 MolecularWeight: 370.48688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)(C)C)NS(=O)(=O)C1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)[C@@H](C(=O)OC(C)(C)C)NS(=O)(=O)C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C16H22N2O4S2/c1-10(2)13(14(19)22-16(3,4)5)18-24(20,21)15-17-11-8-6-7-9-12(11)23-15/h6-10,13,18H,1-5H3/t13-/m0/s1