2-(4-isothiocyanatophenyl)-5-(4-octylcyclohexyl)pyridine

Systemtic Name: 2-(4-isothiocyanatophenyl)-5-(4-octylcyclohexyl)pyridine Openeye Name: 2-(4-isothiocyanatophenyl)-5-(4-octylcyclohexyl)pyridine CAS Name: 2-(4-isothiocyanatophenyl)-5-(4-octylcyclohexyl)pyridine IUPAC Name: 2-(4-isothiocyanatophenyl)-5-(4-octylcyclohexyl)pyridine Traditional Name: 2-(4-isothiocyanatophenyl)-5-(4-octylcyclohexyl)pyridine Formula: C26H34N2S MolecularWeight: 406.62656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C2=CN=C(C=C2)C3=CC=C(C=C3)N=C=S

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C2=CN=C(C=C2)C3=CC=C(C=C3)N=C=S

InChI

InChI=1S/C26H34N2S/c1-2-3-4-5-6-7-8-21-9-11-22(12-10-21)24-15-18-26(27-19-24)23-13-16-25(17-14-23)28-20-29/h13-19,21-22H,2-12H2,1H3