N-[(4-phenylsulfanylphenyl)methyl]propan-1-amine

Systemtic Name: N-[(4-phenylsulfanylphenyl)methyl]propan-1-amine Openeye Name: N-[(4-phenylsulfanylphenyl)methyl]propan-1-amine CAS Name: N-[[4-(phenylthio)phenyl]methyl]-1-propanamine IUPAC Name: N-[(4-phenylsulfanylphenyl)methyl]propan-1-amine Traditional Name: [4-(phenylthio)benzyl]-propyl-amine Formula: C16H19NS MolecularWeight: 257.39376

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=CC=C(C=C1)SC2=CC=CC=C2

Isomeric SMILES

CCCNCC1=CC=C(C=C1)SC2=CC=CC=C2

InChI

InChI=1S/C16H19NS/c1-2-12-17-13-14-8-10-16(11-9-14)18-15-6-4-3-5-7-15/h3-11,17H,2,12-13H2,1H3