6-(1-adamantyl)-2-prop-2-enylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 6-(1-adamantyl)-2-prop-2-enylsulfanyl-pyridine-3-carbonitrile Openeye Name: 6-(1-adamantyl)-2-allylsulfanyl-pyridine-3-carbonitrile CAS Name: 6-(1-adamantyl)-2-(prop-2-enylthio)-3-pyridinecarbonitrile IUPAC Name: 6-(1-adamantyl)-2-prop-2-enylsulfanylpyridine-3-carbonitrile Traditional Name: 6-(1-adamantyl)-2-(allylthio)nicotinonitrile Formula: C19H22N2S MolecularWeight: 310.45638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2S/c1-2-5-22-18-16(12-20)3-4-17(21-18)19-9-13-6-14(10-19)8-15(7-13)11-19/h2-4,13-15H,1,5-11H2