N-[2-[(6-bromanyl-2-methoxy-naphthalen-1-yl)methylsulfanyl]ethyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-[(6-bromanyl-2-methoxy-naphthalen-1-yl)methylsulfanyl]ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-[(6-bromo-2-methoxy-1-naphthyl)methylsulfanyl]ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-[(6-bromo-2-methoxy-1-naphthalenyl)methylthio]ethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-[(6-bromo-2-methoxynaphthalen-1-yl)methylsulfanyl]ethyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-[(6-bromo-2-methoxy-1-naphthyl)methylthio]ethyl]-4-methyl-benzenesulfonamide Formula: C21H22BrNO3S2 MolecularWeight: 480.43828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCSCC2=C(C=CC3=C2C=CC(=C3)Br)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCSCC2=C(C=CC3=C2C=CC(=C3)Br)OC

InChI

InChI=1S/C21H22BrNO3S2/c1-15-3-7-18(8-4-15)28(24,25)23-11-12-27-14-20-19-9-6-17(22)13-16(19)5-10-21(20)26-2/h3-10,13,23H,11-12,14H2,1-2H3