2-phenyl-3-sulfanyl-propane-1-sulfonamide

Systemtic Name: 2-phenyl-3-sulfanyl-propane-1-sulfonamide Openeye Name: 2-phenyl-3-sulfanyl-propane-1-sulfonamide CAS Name: 3-mercapto-2-phenyl-1-propanesulfonamide IUPAC Name: 2-phenyl-3-sulfanylpropane-1-sulfonamide Traditional Name: 3-mercapto-2-phenyl-propane-1-sulfonamide Formula: C9H13NO2S2 MolecularWeight: 231.33502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CS)CS(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C(CS)CS(=O)(=O)N

InChI

InChI=1S/C9H13NO2S2/c10-14(11,12)7-9(6-13)8-4-2-1-3-5-8/h1-5,9,13H,6-7H2,(H2,10,11,12)