N-[(2-phenylsulfanylphenyl)methyl]hexan-1-amine

Systemtic Name: N-[(2-phenylsulfanylphenyl)methyl]hexan-1-amine Openeye Name: N-[(2-phenylsulfanylphenyl)methyl]hexan-1-amine CAS Name: N-[[2-(phenylthio)phenyl]methyl]-1-hexanamine IUPAC Name: N-[(2-phenylsulfanylphenyl)methyl]hexan-1-amine Traditional Name: hexyl-[2-(phenylthio)benzyl]amine Formula: C19H25NS MolecularWeight: 299.4735

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCC1=CC=CC=C1SC2=CC=CC=C2

Isomeric SMILES

CCCCCCNCC1=CC=CC=C1SC2=CC=CC=C2

InChI

InChI=1S/C19H25NS/c1-2-3-4-10-15-20-16-17-11-8-9-14-19(17)21-18-12-6-5-7-13-18/h5-9,11-14,20H,2-4,10,15-16H2,1H3