tert-butyl 2-(phenylsulfonylamino)-3-sulfanyl-propanoate

Systemtic Name: tert-butyl 2-(phenylsulfonylamino)-3-sulfanyl-propanoate Openeye Name: tert-butyl 2-(benzenesulfonamido)-3-sulfanyl-propanoate CAS Name: 2-(benzenesulfonamido)-3-mercaptopropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(benzenesulfonamido)-3-sulfanylpropanoate Traditional Name: 2-(benzenesulfonamido)-3-mercapto-propionic acid tert-butyl ester Formula: C13H19NO4S2 MolecularWeight: 317.42426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CS)NS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)C(CS)NS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H19NO4S2/c1-13(2,3)18-12(15)11(9-19)14-20(16,17)10-7-5-4-6-8-10/h4-8,11,14,19H,9H2,1-3H3