N-(pyridin-3-ylmethylcarbamothioyl)-4-(trifluoromethyl)benzamide

Systemtic Name: N-(pyridin-3-ylmethylcarbamothioyl)-4-(trifluoromethyl)benzamide Openeye Name: N-(3-pyridylmethylcarbamothioyl)-4-(trifluoromethyl)benzamide CAS Name: N-[(3-pyridinylmethylamino)-sulfanylidenemethyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-(pyridin-3-ylmethylcarbamothioyl)-4-(trifluoromethyl)benzamide Traditional Name: N-(3-pyridylmethylthiocarbamoyl)-4-(trifluoromethyl)benzamide Formula: C15H12F3N3OS MolecularWeight: 339.33549

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=S)NC(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1=CC(=CN=C1)CNC(=S)NC(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C15H12F3N3OS/c16-15(17,18)12-5-3-11(4-6-12)13(22)21-14(23)20-9-10-2-1-7-19-8-10/h1-8H,9H2,(H2,20,21,22,23)