6-methyl-N-[(4-methylsulfanylphenyl)methyl]heptan-2-amine

Systemtic Name: 6-methyl-N-[(4-methylsulfanylphenyl)methyl]heptan-2-amine Openeye Name: 6-methyl-N-[(4-methylsulfanylphenyl)methyl]heptan-2-amine CAS Name: 6-methyl-N-[[4-(methylthio)phenyl]methyl]-2-heptanamine IUPAC Name: 6-methyl-N-[(4-methylsulfanylphenyl)methyl]heptan-2-amine Traditional Name: 1,5-dimethylhexyl-[4-(methylthio)benzyl]amine Formula: C16H27NS MolecularWeight: 265.45728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NCC1=CC=C(C=C1)SC

Isomeric SMILES

CC(C)CCCC(C)NCC1=CC=C(C=C1)SC

InChI

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