4-fluoranyl-3-[(2-methylimidazol-1-yl)methyl]benzenecarbothioamide

Systemtic Name: 4-fluoranyl-3-[(2-methylimidazol-1-yl)methyl]benzenecarbothioamide Openeye Name: 4-fluoro-3-[(2-methylimidazol-1-yl)methyl]benzenecarbothioamide CAS Name: 4-fluoro-3-[(2-methyl-1-imidazolyl)methyl]benzenecarbothioamide IUPAC Name: 4-fluoro-3-[(2-methylimidazol-1-yl)methyl]benzenecarbothioamide Traditional Name: 4-fluoro-3-[(2-methylimidazol-1-yl)methyl]thiobenzamide Formula: C12H12FN3S MolecularWeight: 249.307183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1CC2=C(C=CC(=C2)C(=S)N)F

Isomeric SMILES

CC1=NC=CN1CC2=C(C=CC(=C2)C(=S)N)F

InChI

InChI=1S/C12H12FN3S/c1-8-15-4-5-16(8)7-10-6-9(12(14)17)2-3-11(10)13/h2-6H,7H2,1H3,(H2,14,17)