3-(phenylmethylsulfanyl)-2-(phenylsulfonylamino)propanoic acid

Systemtic Name: 3-(phenylmethylsulfanyl)-2-(phenylsulfonylamino)propanoic acid Openeye Name: 2-(benzenesulfonamido)-3-benzylsulfanyl-propanoic acid CAS Name: 2-(benzenesulfonamido)-3-(phenylmethylthio)propanoic acid IUPAC Name: 2-(benzenesulfonamido)-3-benzylsulfanylpropanoic acid Traditional Name: 2-(benzenesulfonamido)-3-(benzylthio)propionic acid Formula: C16H17NO4S2 MolecularWeight: 351.44048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(C(=O)O)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CSCC(C(=O)O)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H17NO4S2/c18-16(19)15(12-22-11-13-7-3-1-4-8-13)17-23(20,21)14-9-5-2-6-10-14/h1-10,15,17H,11-12H2,(H,18,19)