2-[1-(methylamino)pentylsulfanyl]-6-(trifluoromethyl)pyridine-3-carbonitrile hydrochloride

Systemtic Name: 2-[1-(methylamino)pentylsulfanyl]-6-(trifluoromethyl)pyridine-3-carbonitrile hydrochloride Openeye Name: 2-[1-(methylamino)pentylsulfanyl]-6-(trifluoromethyl)pyridine-3-carbonitrile hydrochloride CAS Name: 2-[1-(methylamino)pentylthio]-6-(trifluoromethyl)-3-pyridinecarbonitrile hydrochloride IUPAC Name: 2-[1-(methylamino)pentylsulfanyl]-6-(trifluoromethyl)pyridine-3-carbonitrile hydrochloride Traditional Name: 2-[1-(methylamino)pentylthio]-6-(trifluoromethyl)nicotinonitrile hydrochloride Formula: C13H17ClF3N3S MolecularWeight: 339.80739

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(NC)SC1=C(C=CC(=N1)C(F)(F)F)C#N.Cl

Isomeric SMILES

CCCCC(NC)SC1=C(C=CC(=N1)C(F)(F)F)C#N.Cl

InChI

InChI=1S/C13H16F3N3S.ClH/c1-3-4-5-11(18-2)20-12-9(8-17)6-7-10(19-12)13(14,15)16;/h6-7,11,18H,3-5H2,1-2H3;1H