2-sulfanylidene-N-[3-[[5-(trifluoromethyl)pyridin-2-yl]amino]propyl]-1H-pyridine-3-carboxamide

Systemtic Name: 2-sulfanylidene-N-[3-[[5-(trifluoromethyl)pyridin-2-yl]amino]propyl]-1H-pyridine-3-carboxamide Openeye Name: 2-thioxo-N-[3-[[5-(trifluoromethyl)-2-pyridyl]amino]propyl]-1H-pyridine-3-carboxamide CAS Name: 2-sulfanylidene-N-[3-[[5-(trifluoromethyl)-2-pyridinyl]amino]propyl]-1H-pyridine-3-carboxamide IUPAC Name: 2-sulfanylidene-N-[3-[[5-(trifluoromethyl)pyridin-2-yl]amino]propyl]-1H-pyridine-3-carboxamide Traditional Name: 2-thioxo-N-[3-[[5-(trifluoromethyl)-2-pyridyl]amino]propyl]-1H-pyridine-3-carboxamide Formula: C15H15F3N4OS MolecularWeight: 356.36601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=S)C(=C1)C(=O)NCCCNC2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1=CNC(=S)C(=C1)C(=O)NCCCNC2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C15H15F3N4OS/c16-15(17,18)10-4-5-12(22-9-10)19-7-2-8-20-13(23)11-3-1-6-21-14(11)24/h1,3-6,9H,2,7-8H2,(H,19,22)(H,20,23)(H,21,24)