4-[4-(5-ethyl-1,3-dithian-2-yl)phenyl]-1-propyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-(5-ethyl-1,3-dithian-2-yl)phenyl]-1-propyl-cyclohexane-1-carbonitrile Openeye Name: 4-[4-(5-ethyl-1,3-dithian-2-yl)phenyl]-1-propyl-cyclohexanecarbonitrile CAS Name: 4-[4-(5-ethyl-1,3-dithian-2-yl)phenyl]-1-propyl-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-(5-ethyl-1,3-dithian-2-yl)phenyl]-1-propylcyclohexane-1-carbonitrile Traditional Name: 4-[4-(5-ethyl-1,3-dithian-2-yl)phenyl]-1-propyl-cyclohexanecarbonitrile Formula: C22H31NS2 MolecularWeight: 373.61824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCC(CC1)C2=CC=C(C=C2)C3SCC(CS3)CC)C#N

Isomeric SMILES

CCCC1(CCC(CC1)C2=CC=C(C=C2)C3SCC(CS3)CC)C#N

InChI

InChI=1S/C22H31NS2/c1-3-11-22(16-23)12-9-19(10-13-22)18-5-7-20(8-6-18)21-24-14-17(4-2)15-25-21/h5-8,17,19,21H,3-4,9-15H2,1-2H3