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

Systemtic Name: 3-bromanyl-4-methoxy-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide Openeye Name: 3-bromo-4-methoxy-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide CAS Name: 3-bromo-4-methoxy-N-[4-[(phenylthio)methyl]phenyl]benzenesulfonamide IUPAC Name: 3-bromo-4-methoxy-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide Traditional Name: 3-bromo-4-methoxy-N-[4-[(phenylthio)methyl]phenyl]benzenesulfonamide Formula: C20H18BrNO3S2 MolecularWeight: 464.39582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)Br

InChI

InChI=1S/C20H18BrNO3S2/c1-25-20-12-11-18(13-19(20)21)27(23,24)22-16-9-7-15(8-10-16)14-26-17-5-3-2-4-6-17/h2-13,22H,14H2,1H3