3-bromanyl-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide

Systemtic Name: 3-bromanyl-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide Openeye Name: 3-bromo-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide CAS Name: 3-bromo-N-[4-[(phenylthio)methyl]phenyl]benzenesulfonamide IUPAC Name: 3-bromo-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide Traditional Name: 3-bromo-N-[4-[(phenylthio)methyl]phenyl]benzenesulfonamide Formula: C19H16BrNO2S2 MolecularWeight: 434.36984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC2=CC=C(C=C2)NS(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)SCC2=CC=C(C=C2)NS(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H16BrNO2S2/c20-16-5-4-8-19(13-16)25(22,23)21-17-11-9-15(10-12-17)14-24-18-6-2-1-3-7-18/h1-13,21H,14H2