butyl-[(5-carbamothioyl-2-fluoranyl-phenyl)methyl]-methyl-azanium

Systemtic Name: butyl-[(5-carbamothioyl-2-fluoranyl-phenyl)methyl]-methyl-azanium Openeye Name: butyl-[(5-carbamothioyl-2-fluoro-phenyl)methyl]-methyl-ammonium CAS Name: butyl-[(5-carbamothioyl-2-fluorophenyl)methyl]-methylammonium IUPAC Name: butyl-[(5-carbamothioyl-2-fluorophenyl)methyl]-methylazanium Traditional Name: butyl-(2-fluoro-5-thiocarbamoyl-benzyl)-methyl-ammonium Formula: C13H20FN2S+ MolecularWeight: 255.374703

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC1=C(C=CC(=C1)C(=S)N)F

Isomeric SMILES

CCCC[NH+](C)CC1=C(C=CC(=C1)C(=S)N)F

InChI

InChI=1S/C13H19FN2S/c1-3-4-7-16(2)9-11-8-10(13(15)17)5-6-12(11)14/h5-6,8H,3-4,7,9H2,1-2H3,(H2,15,17)/p+1