1-isothiocyanato-4-[2-[4-(4-pentylcyclohexyl)phenyl]ethyl]benzene

Systemtic Name: 1-isothiocyanato-4-[2-[4-(4-pentylcyclohexyl)phenyl]ethyl]benzene Openeye Name: 1-isothiocyanato-4-[2-[4-(4-pentylcyclohexyl)phenyl]ethyl]benzene CAS Name: 1-isothiocyanato-4-[2-[4-(4-pentylcyclohexyl)phenyl]ethyl]benzene IUPAC Name: 1-isothiocyanato-4-[2-[4-(4-pentylcyclohexyl)phenyl]ethyl]benzene Traditional Name: 1-(4-amylcyclohexyl)-4-[2-(4-isothiocyanatophenyl)ethyl]benzene Formula: C26H33NS MolecularWeight: 391.61192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)CCC3=CC=C(C=C3)N=C=S

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)CCC3=CC=C(C=C3)N=C=S

InChI

InChI=1S/C26H33NS/c1-2-3-4-5-21-8-14-24(15-9-21)25-16-10-22(11-17-25)6-7-23-12-18-26(19-13-23)27-20-28/h10-13,16-19,21,24H,2-9,14-15H2,1H3