6-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbothioamide

Systemtic Name: 6-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbothioamide Openeye Name: 6-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbothioamide CAS Name: 6-[[3-(trifluoromethyl)phenyl]methylamino]-3-pyridinecarbothioamide IUPAC Name: 6-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbothioamide Traditional Name: 6-[[3-(trifluoromethyl)benzyl]amino]thionicotinamide Formula: C14H12F3N3S MolecularWeight: 311.32539

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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