2-ethyl-N-[(4-methylsulfanylphenyl)methyl]hexan-1-amine

Systemtic Name: 2-ethyl-N-[(4-methylsulfanylphenyl)methyl]hexan-1-amine Openeye Name: 2-ethyl-N-[(4-methylsulfanylphenyl)methyl]hexan-1-amine CAS Name: 2-ethyl-N-[[4-(methylthio)phenyl]methyl]-1-hexanamine IUPAC Name: 2-ethyl-N-[(4-methylsulfanylphenyl)methyl]hexan-1-amine Traditional Name: 2-ethylhexyl-[4-(methylthio)benzyl]amine Formula: C16H27NS MolecularWeight: 265.45728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNCC1=CC=C(C=C1)SC

Isomeric SMILES

CCCCC(CC)CNCC1=CC=C(C=C1)SC

InChI

InChI=1S/C16H27NS/c1-4-6-7-14(5-2)12-17-13-15-8-10-16(18-3)11-9-15/h8-11,14,17H,4-7,12-13H2,1-3H3