1-(4-hexylcyclohexyl)-4-[4-(4-isothiocyanatocyclohexyl)phenyl]benzene

Systemtic Name: 1-(4-hexylcyclohexyl)-4-[4-(4-isothiocyanatocyclohexyl)phenyl]benzene Openeye Name: 1-(4-hexylcyclohexyl)-4-[4-(4-isothiocyanatocyclohexyl)phenyl]benzene CAS Name: 1-(4-hexylcyclohexyl)-4-[4-(4-isothiocyanatocyclohexyl)phenyl]benzene IUPAC Name: 1-(4-hexylcyclohexyl)-4-[4-(4-isothiocyanatocyclohexyl)phenyl]benzene Traditional Name: 1-(4-hexylcyclohexyl)-4-[4-(4-isothiocyanatocyclohexyl)phenyl]benzene Formula: C31H41NS MolecularWeight: 459.72894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)N=C=S

Isomeric SMILES

CCCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)N=C=S

InChI

InChI=1S/C31H41NS/c1-2-3-4-5-6-24-7-9-25(10-8-24)26-11-13-27(14-12-26)28-15-17-29(18-16-28)30-19-21-31(22-20-30)32-23-33/h11-18,24-25,30-31H,2-10,19-22H2,1H3