6-(1-adamantyl)-2-ethylsulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-(1-adamantyl)-2-ethylsulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-(1-adamantyl)-2-ethylsulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-(1-adamantyl)-2-(ethylthio)-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-(1-adamantyl)-2-ethylsulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 6-(1-adamantyl)-2-(ethylthio)-4-(trifluoromethyl)nicotinonitrile Formula: C19H21F3N2S MolecularWeight: 366.44365

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=CC(=N1)C23CC4CC(C2)CC(C4)C3)C(F)(F)F)C#N

Isomeric SMILES

CCSC1=C(C(=CC(=N1)C23CC4CC(C2)CC(C4)C3)C(F)(F)F)C#N

InChI

InChI=1S/C19H21F3N2S/c1-2-25-17-14(10-23)15(19(20,21)22)6-16(24-17)18-7-11-3-12(8-18)5-13(4-11)9-18/h6,11-13H,2-5,7-9H2,1H3