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

Systemtic Name: [3-[3-(2-bromophenyl)sulfanylpropoxy]phenyl]methanamine Openeye Name: [3-[3-(2-bromophenyl)sulfanylpropoxy]phenyl]methanamine CAS Name: [3-[3-[(2-bromophenyl)thio]propoxy]phenyl]methanamine IUPAC Name: [3-[3-(2-bromophenyl)sulfanylpropoxy]phenyl]methanamine Traditional Name: [3-[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)SCCCOC2=CC=CC(=C2)CN)Br

Isomeric SMILES

C1=CC=C(C(=C1)SCCCOC2=CC=CC(=C2)CN)Br

InChI

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