[azanyl-[4-(tert-butylsulfanylmethyl)-3-fluoranyl-phenyl]methylidene]azanium

Systemtic Name: [azanyl-[4-(tert-butylsulfanylmethyl)-3-fluoranyl-phenyl]methylidene]azanium Openeye Name: [amino-[4-(tert-butylsulfanylmethyl)-3-fluoro-phenyl]methylene]ammonium CAS Name: [amino-[4-[(tert-butylthio)methyl]-3-fluorophenyl]methylidene]ammonium IUPAC Name: [amino-[4-(tert-butylsulfanylmethyl)-3-fluorophenyl]methylidene]azanium Traditional Name: [amino-[4-[(tert-butylthio)methyl]-3-fluoro-phenyl]methylene]ammonium Formula: C12H18FN2S+ MolecularWeight: 241.348123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC1=C(C=C(C=C1)C(=[NH2+])N)F

Isomeric SMILES

CC(C)(C)SCC1=C(C=C(C=C1)C(=[NH2+])N)F

InChI

InChI=1S/C12H17FN2S/c1-12(2,3)16-7-9-5-4-8(11(14)15)6-10(9)13/h4-6H,7H2,1-3H3,(H3,14,15)/p+1