3-fluoranyl-4-heptylsulfanyl-aniline

Systemtic Name: 3-fluoranyl-4-heptylsulfanyl-aniline Openeye Name: 3-fluoro-4-heptylsulfanyl-aniline CAS Name: 3-fluoro-4-(heptylthio)aniline IUPAC Name: 3-fluoro-4-heptylsulfanylaniline Traditional Name: [3-fluoro-4-(heptylthio)phenyl]amine Formula: C13H20FNS MolecularWeight: 241.368003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=C(C=C(C=C1)N)F

Isomeric SMILES

CCCCCCCSC1=C(C=C(C=C1)N)F

InChI

InChI=1S/C13H20FNS/c1-2-3-4-5-6-9-16-13-8-7-11(15)10-12(13)14/h7-8,10H,2-6,9,15H2,1H3