4-fluoranyl-3-[(2-propan-2-yl-1H-imidazol-3-ium-3-yl)methyl]benzenecarbothioamide

Systemtic Name: 4-fluoranyl-3-[(2-propan-2-yl-1H-imidazol-3-ium-3-yl)methyl]benzenecarbothioamide Openeye Name: 4-fluoro-3-[(2-isopropyl-1H-imidazol-3-ium-3-yl)methyl]benzenecarbothioamide CAS Name: 4-fluoro-3-[(2-propan-2-yl-1H-imidazol-3-ium-3-yl)methyl]benzenecarbothioamide IUPAC Name: 4-fluoro-3-[(2-propan-2-yl-1H-imidazol-3-ium-3-yl)methyl]benzenecarbothioamide Traditional Name: 4-fluoro-3-[(2-isopropyl-1H-imidazol-3-ium-3-yl)methyl]thiobenzamide Formula: C14H17FN3S+ MolecularWeight: 278.368283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[N+](C=CN1)CC2=C(C=CC(=C2)C(=S)N)F

Isomeric SMILES

CC(C)C1=[N+](C=CN1)CC2=C(C=CC(=C2)C(=S)N)F

InChI

InChI=1S/C14H16FN3S/c1-9(2)14-17-5-6-18(14)8-11-7-10(13(16)19)3-4-12(11)15/h3-7,9H,8H2,1-2H3,(H2,16,19)/p+1