2-(pyridin-2-ylmethylamino)-5-(trifluoromethyl)benzenecarbothioamide

Systemtic Name: 2-(pyridin-2-ylmethylamino)-5-(trifluoromethyl)benzenecarbothioamide Openeye Name: 2-(2-pyridylmethylamino)-5-(trifluoromethyl)benzenecarbothioamide CAS Name: 2-(2-pyridinylmethylamino)-5-(trifluoromethyl)benzenecarbothioamide IUPAC Name: 2-(pyridin-2-ylmethylamino)-5-(trifluoromethyl)benzenecarbothioamide Traditional Name: 2-(2-pyridylmethylamino)-5-(trifluoromethyl)thiobenzamide Formula: C14H12F3N3S MolecularWeight: 311.32539

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC2=C(C=C(C=C2)C(F)(F)F)C(=S)N

Isomeric SMILES

C1=CC=NC(=C1)CNC2=C(C=C(C=C2)C(F)(F)F)C(=S)N

InChI

InChI=1S/C14H12F3N3S/c15-14(16,17)9-4-5-12(11(7-9)13(18)21)20-8-10-3-1-2-6-19-10/h1-7,20H,8H2,(H2,18,21)