N-[1-(4-methylsulfanylphenyl)ethyl]cycloheptanamine

Systemtic Name: N-[1-(4-methylsulfanylphenyl)ethyl]cycloheptanamine Openeye Name: N-[1-(4-methylsulfanylphenyl)ethyl]cycloheptanamine CAS Name: N-[1-[4-(methylthio)phenyl]ethyl]cycloheptanamine IUPAC Name: N-[1-(4-methylsulfanylphenyl)ethyl]cycloheptanamine Traditional Name: cycloheptyl-[1-[4-(methylthio)phenyl]ethyl]amine Formula: C16H25NS MolecularWeight: 263.4414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC)NC2CCCCCC2

Isomeric SMILES

CC(C1=CC=C(C=C1)SC)NC2CCCCCC2

InChI

InChI=1S/C16H25NS/c1-13(14-9-11-16(18-2)12-10-14)17-15-7-5-3-4-6-8-15/h9-13,15,17H,3-8H2,1-2H3