4-(5-ethyl-1,3-dithian-2-yl)-1-heptyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-(5-ethyl-1,3-dithian-2-yl)-1-heptyl-cyclohexane-1-carbonitrile Openeye Name: 4-(5-ethyl-1,3-dithian-2-yl)-1-heptyl-cyclohexanecarbonitrile CAS Name: 4-(5-ethyl-1,3-dithian-2-yl)-1-heptyl-1-cyclohexanecarbonitrile IUPAC Name: 4-(5-ethyl-1,3-dithian-2-yl)-1-heptylcyclohexane-1-carbonitrile Traditional Name: 4-(5-ethyl-1,3-dithian-2-yl)-1-heptyl-cyclohexanecarbonitrile Formula: C20H35NS2 MolecularWeight: 353.6286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(CCC(CC1)C2SCC(CS2)CC)C#N

Isomeric SMILES

CCCCCCCC1(CCC(CC1)C2SCC(CS2)CC)C#N

InChI

InChI=1S/C20H35NS2/c1-3-5-6-7-8-11-20(16-21)12-9-18(10-13-20)19-22-14-17(4-2)15-23-19/h17-19H,3-15H2,1-2H3