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

Systemtic Name: 1-(4-isothiocyanatocyclohexyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene Openeye Name: 1-(4-isothiocyanatocyclohexyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene CAS Name: 1-(4-isothiocyanatocyclohexyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene IUPAC Name: 1-(4-isothiocyanatocyclohexyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene Traditional Name: 1-(4-isothiocyanatocyclohexyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene Formula: C28H35NS MolecularWeight: 417.6492

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)N=C=S

Isomeric SMILES

CCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)N=C=S

InChI

InChI=1S/C28H35NS/c1-2-3-21-4-6-22(7-5-21)23-8-10-24(11-9-23)25-12-14-26(15-13-25)27-16-18-28(19-17-27)29-20-30/h8-15,21-22,27-28H,2-7,16-19H2,1H3