2-[3-(4-fluorophenyl)sulfanyl-2-hexyl-phenyl]-N-methyl-ethanamine

Systemtic Name: 2-[3-(4-fluorophenyl)sulfanyl-2-hexyl-phenyl]-N-methyl-ethanamine Openeye Name: 2-[3-(4-fluorophenyl)sulfanyl-2-hexyl-phenyl]-N-methyl-ethanamine CAS Name: 2-[3-[(4-fluorophenyl)thio]-2-hexylphenyl]-N-methylethanamine IUPAC Name: 2-[3-(4-fluorophenyl)sulfanyl-2-hexylphenyl]-N-methylethanamine Traditional Name: 2-[3-[(4-fluorophenyl)thio]-2-hexyl-phenyl]ethyl-methyl-amine Formula: C21H28FNS MolecularWeight: 345.517123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=CC=C1SC2=CC=C(C=C2)F)CCNC

Isomeric SMILES

CCCCCCC1=C(C=CC=C1SC2=CC=C(C=C2)F)CCNC

InChI

InChI=1S/C21H28FNS/c1-3-4-5-6-9-20-17(15-16-23-2)8-7-10-21(20)24-19-13-11-18(22)12-14-19/h7-8,10-14,23H,3-6,9,15-16H2,1-2H3