3-(1-pyridin-2-ylsulfanylprop-2-enyl)cyclohexan-1-one

Systemtic Name: 3-(1-pyridin-2-ylsulfanylprop-2-enyl)cyclohexan-1-one Openeye Name: 3-[1-(2-pyridylsulfanyl)allyl]cyclohexanone CAS Name: 3-[1-(2-pyridinylthio)prop-2-enyl]-1-cyclohexanone IUPAC Name: 3-(1-pyridin-2-ylsulfanylprop-2-enyl)cyclohexan-1-one Traditional Name: 3-[1-(2-pyridylthio)allyl]cyclohexanone Formula: C14H17NOS MolecularWeight: 247.35588

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(C1CCCC(=O)C1)SC2=CC=CC=N2

Isomeric SMILES

C=CC(C1CCCC(=O)C1)SC2=CC=CC=N2

InChI

InChI=1S/C14H17NOS/c1-2-13(11-6-5-7-12(16)10-11)17-14-8-3-4-9-15-14/h2-4,8-9,11,13H,1,5-7,10H2