1-[4-[4-(4-hexylcyclohexyl)cyclohexyl]cyclohexyl]-4-isothiocyanato-benzene

Systemtic Name: 1-[4-[4-(4-hexylcyclohexyl)cyclohexyl]cyclohexyl]-4-isothiocyanato-benzene Openeye Name: 1-[4-[4-(4-hexylcyclohexyl)cyclohexyl]cyclohexyl]-4-isothiocyanato-benzene CAS Name: 1-[4-[4-(4-hexylcyclohexyl)cyclohexyl]cyclohexyl]-4-isothiocyanatobenzene IUPAC Name: 1-[4-[4-(4-hexylcyclohexyl)cyclohexyl]cyclohexyl]-4-isothiocyanatobenzene Traditional Name: 1-[4-[4-(4-hexylcyclohexyl)cyclohexyl]cyclohexyl]-4-isothiocyanato-benzene Formula: C31H47NS MolecularWeight: 465.77658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2CCC(CC2)C3CCC(CC3)C4=CC=C(C=C4)N=C=S

Isomeric SMILES

CCCCCCC1CCC(CC1)C2CCC(CC2)C3CCC(CC3)C4=CC=C(C=C4)N=C=S

InChI

InChI=1S/C31H47NS/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/h19-22,24-29H,2-18H2,1H3