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

Systemtic Name: N-[(2-phenylsulfanylphenyl)methyl]butan-1-amine Openeye Name: N-[(2-phenylsulfanylphenyl)methyl]butan-1-amine CAS Name: N-[[2-(phenylthio)phenyl]methyl]-1-butanamine IUPAC Name: N-[(2-phenylsulfanylphenyl)methyl]butan-1-amine Traditional Name: butyl-[2-(phenylthio)benzyl]amine Formula: C17H21NS MolecularWeight: 271.42034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=CC=CC=C1SC2=CC=CC=C2

Isomeric SMILES

CCCCNCC1=CC=CC=C1SC2=CC=CC=C2

InChI

InChI=1S/C17H21NS/c1-2-3-13-18-14-15-9-7-8-12-17(15)19-16-10-5-4-6-11-16/h4-12,18H,2-3,13-14H2,1H3