N-[(4-methylsulfanylphenyl)methyl]heptan-1-amine

Systemtic Name: N-[(4-methylsulfanylphenyl)methyl]heptan-1-amine Openeye Name: N-[(4-methylsulfanylphenyl)methyl]heptan-1-amine CAS Name: N-[[4-(methylthio)phenyl]methyl]-1-heptanamine IUPAC Name: N-[(4-methylsulfanylphenyl)methyl]heptan-1-amine Traditional Name: heptyl-[4-(methylthio)benzyl]amine Formula: C15H25NS MolecularWeight: 251.4307

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNCC1=CC=C(C=C1)SC

Isomeric SMILES

CCCCCCCNCC1=CC=C(C=C1)SC

InChI

InChI=1S/C15H25NS/c1-3-4-5-6-7-12-16-13-14-8-10-15(17-2)11-9-14/h8-11,16H,3-7,12-13H2,1-2H3