5-bromanyl-2-[2-(2,5-dimethylphenoxy)ethylsulfanyl]aniline

Systemtic Name: 5-bromanyl-2-[2-(2,5-dimethylphenoxy)ethylsulfanyl]aniline Openeye Name: 5-bromo-2-[2-(2,5-dimethylphenoxy)ethylsulfanyl]aniline CAS Name: 5-bromo-2-[2-(2,5-dimethylphenoxy)ethylthio]aniline IUPAC Name: 5-bromo-2-[2-(2,5-dimethylphenoxy)ethylsulfanyl]aniline Traditional Name: [5-bromo-2-[2-(2,5-dimethylphenoxy)ethylthio]phenyl]amine Formula: C16H18BrNOS MolecularWeight: 352.28922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCSC2=C(C=C(C=C2)Br)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCSC2=C(C=C(C=C2)Br)N

InChI

InChI=1S/C16H18BrNOS/c1-11-3-4-12(2)15(9-11)19-7-8-20-16-6-5-13(17)10-14(16)18/h3-6,9-10H,7-8,18H2,1-2H3