2-[1-(methylamino)pentan-3-ylsulfanyl]-6-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[1-(methylamino)pentan-3-ylsulfanyl]-6-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[1-ethyl-3-(methylamino)propyl]sulfanyl-6-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[1-(methylamino)pentan-3-ylthio]-6-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[1-(methylamino)pentan-3-ylsulfanyl]-6-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[[1-ethyl-3-(methylamino)propyl]thio]-6-(trifluoromethyl)nicotinonitrile Formula: C13H16F3N3S MolecularWeight: 303.34645

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCNC)SC1=C(C=CC(=N1)C(F)(F)F)C#N

Isomeric SMILES

CCC(CCNC)SC1=C(C=CC(=N1)C(F)(F)F)C#N

InChI

InChI=1S/C13H16F3N3S/c1-3-10(6-7-18-2)20-12-9(8-17)4-5-11(19-12)13(14,15)16/h4-5,10,18H,3,6-7H2,1-2H3