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

Systemtic Name: 1-[4-(4-hexylcyclohexyl)cyclohexyl]-4-isothiocyanato-benzene Openeye Name: 1-[4-(4-hexylcyclohexyl)cyclohexyl]-4-isothiocyanato-benzene CAS Name: 1-[4-(4-hexylcyclohexyl)cyclohexyl]-4-isothiocyanatobenzene IUPAC Name: 1-[4-(4-hexylcyclohexyl)cyclohexyl]-4-isothiocyanatobenzene Traditional Name: 1-[4-(4-hexylcyclohexyl)cyclohexyl]-4-isothiocyanato-benzene Formula: C25H37NS MolecularWeight: 383.63298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)N=C=S

Isomeric SMILES

CCCCCCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)N=C=S

InChI

InChI=1S/C25H37NS/c1-2-3-4-5-6-20-7-9-21(10-8-20)22-11-13-23(14-12-22)24-15-17-25(18-16-24)26-19-27/h15-18,20-23H,2-14H2,1H3