1-isothiocyanato-4-[4-[1-(4-pentylcyclohexyl)ethyl]cyclohexyl]benzene

Systemtic Name: 1-isothiocyanato-4-[4-[1-(4-pentylcyclohexyl)ethyl]cyclohexyl]benzene Openeye Name: 1-isothiocyanato-4-[4-[1-(4-pentylcyclohexyl)ethyl]cyclohexyl]benzene CAS Name: 1-isothiocyanato-4-[4-[1-(4-pentylcyclohexyl)ethyl]cyclohexyl]benzene IUPAC Name: 1-isothiocyanato-4-[4-[1-(4-pentylcyclohexyl)ethyl]cyclohexyl]benzene Traditional Name: 1-[4-[1-(4-amylcyclohexyl)ethyl]cyclohexyl]-4-isothiocyanato-benzene Formula: C26H39NS MolecularWeight: 397.65956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C(C)C2CCC(CC2)C3=CC=C(C=C3)N=C=S

Isomeric SMILES

CCCCCC1CCC(CC1)C(C)C2CCC(CC2)C3=CC=C(C=C3)N=C=S

InChI

InChI=1S/C26H39NS/c1-3-4-5-6-21-7-9-22(10-8-21)20(2)23-11-13-24(14-12-23)25-15-17-26(18-16-25)27-19-28/h15-18,20-24H,3-14H2,1-2H3