[2-[3-(2-bromophenyl)sulfanylpropoxy]phenyl]methanamine

Systemtic Name: [2-[3-(2-bromophenyl)sulfanylpropoxy]phenyl]methanamine Openeye Name: [2-[3-(2-bromophenyl)sulfanylpropoxy]phenyl]methanamine CAS Name: [2-[3-[(2-bromophenyl)thio]propoxy]phenyl]methanamine IUPAC Name: [2-[3-(2-bromophenyl)sulfanylpropoxy]phenyl]methanamine Traditional Name: [2-[3-[(2-bromophenyl)thio]propoxy]benzyl]amine Formula: C16H18BrNOS MolecularWeight: 352.28922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN)OCCCSC2=CC=CC=C2Br

Isomeric SMILES

C1=CC=C(C(=C1)CN)OCCCSC2=CC=CC=C2Br

InChI

InChI=1S/C16H18BrNOS/c17-14-7-2-4-9-16(14)20-11-5-10-19-15-8-3-1-6-13(15)12-18/h1-4,6-9H,5,10-12,18H2