[4-[3-(2-bromophenyl)sulfanylpropoxy]phenyl]methanamine

Systemtic Name: [4-[3-(2-bromophenyl)sulfanylpropoxy]phenyl]methanamine Openeye Name: [4-[3-(2-bromophenyl)sulfanylpropoxy]phenyl]methanamine CAS Name: [4-[3-[(2-bromophenyl)thio]propoxy]phenyl]methanamine IUPAC Name: [4-[3-(2-bromophenyl)sulfanylpropoxy]phenyl]methanamine Traditional Name: [4-[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=C(C=C2)CN)Br

Isomeric SMILES

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

InChI

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