6-tert-butyl-2-(2-piperidin-1-ylethylsulfanyl)-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-tert-butyl-2-(2-piperidin-1-ylethylsulfanyl)-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-tert-butyl-2-[2-(1-piperidyl)ethylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-tert-butyl-2-[2-(1-piperidinyl)ethylthio]-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-tert-butyl-2-(2-piperidin-1-ylethylsulfanyl)-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 6-tert-butyl-2-(2-piperidinoethylthio)-4-(trifluoromethyl)nicotinonitrile Formula: C18H24F3N3S MolecularWeight: 371.46347

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=C(C(=C1)C(F)(F)F)C#N)SCCN2CCCCC2

Isomeric SMILES

CC(C)(C)C1=NC(=C(C(=C1)C(F)(F)F)C#N)SCCN2CCCCC2

InChI

InChI=1S/C18H24F3N3S/c1-17(2,3)15-11-14(18(19,20)21)13(12-22)16(23-15)25-10-9-24-7-5-4-6-8-24/h11H,4-10H2,1-3H3