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

Systemtic Name: 1-(4-isothiocyanatocyclohexyl)-4-[4-(1-pentylcyclohexyl)phenyl]benzene Openeye Name: 1-(4-isothiocyanatocyclohexyl)-4-[4-(1-pentylcyclohexyl)phenyl]benzene CAS Name: 1-(4-isothiocyanatocyclohexyl)-4-[4-(1-pentylcyclohexyl)phenyl]benzene IUPAC Name: 1-(4-isothiocyanatocyclohexyl)-4-[4-(1-pentylcyclohexyl)phenyl]benzene Traditional Name: 1-(1-amylcyclohexyl)-4-[4-(4-isothiocyanatocyclohexyl)phenyl]benzene Formula: C30H39NS MolecularWeight: 445.70236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(CCCCC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)N=C=S

Isomeric SMILES

CCCCCC1(CCCCC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)N=C=S

InChI

InChI=1S/C30H39NS/c1-2-3-5-20-30(21-6-4-7-22-30)28-16-12-26(13-17-28)24-8-10-25(11-9-24)27-14-18-29(19-15-27)31-23-32/h8-13,16-17,27,29H,2-7,14-15,18-22H2,1H3