6-(1-adamantylsulfanyl)pyridine-3-carbonitrile

Systemtic Name: 6-(1-adamantylsulfanyl)pyridine-3-carbonitrile Openeye Name: 6-(1-adamantylsulfanyl)pyridine-3-carbonitrile CAS Name: 6-(1-adamantylthio)-3-pyridinecarbonitrile IUPAC Name: 6-(1-adamantylsulfanyl)pyridine-3-carbonitrile Traditional Name: 6-(1-adamantylthio)nicotinonitrile Formula: C16H18N2S MolecularWeight: 270.39252

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)SC4=NC=C(C=C4)C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)SC4=NC=C(C=C4)C#N

InChI

InChI=1S/C16H18N2S/c17-9-11-1-2-15(18-10-11)19-16-6-12-3-13(7-16)5-14(4-12)8-16/h1-2,10,12-14H,3-8H2