3-bromanyl-4-methoxy-N-[2-(phenylmethylsulfanyl)ethyl]benzenesulfonamide

Systemtic Name: 3-bromanyl-4-methoxy-N-[2-(phenylmethylsulfanyl)ethyl]benzenesulfonamide Openeye Name: N-(2-benzylsulfanylethyl)-3-bromo-4-methoxy-benzenesulfonamide CAS Name: 3-bromo-4-methoxy-N-[2-(phenylmethylthio)ethyl]benzenesulfonamide IUPAC Name: N-(2-benzylsulfanylethyl)-3-bromo-4-methoxybenzenesulfonamide Traditional Name: N-[2-(benzylthio)ethyl]-3-bromo-4-methoxy-benzenesulfonamide Formula: C16H18BrNO3S2 MolecularWeight: 416.35302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCCSCC2=CC=CC=C2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCCSCC2=CC=CC=C2)Br

InChI

InChI=1S/C16H18BrNO3S2/c1-21-16-8-7-14(11-15(16)17)23(19,20)18-9-10-22-12-13-5-3-2-4-6-13/h2-8,11,18H,9-10,12H2,1H3