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

Systemtic Name: 2-(4-isothiocyanatophenyl)-5-(4-undecylcyclohexyl)pyridine Openeye Name: 2-(4-isothiocyanatophenyl)-5-(4-undecylcyclohexyl)pyridine CAS Name: 2-(4-isothiocyanatophenyl)-5-(4-undecylcyclohexyl)pyridine IUPAC Name: 2-(4-isothiocyanatophenyl)-5-(4-undecylcyclohexyl)pyridine Traditional Name: 2-(4-isothiocyanatophenyl)-5-(4-undecylcyclohexyl)pyridine Formula: C29H40N2S MolecularWeight: 448.7063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1CCC(CC1)C2=CN=C(C=C2)C3=CC=C(C=C3)N=C=S

Isomeric SMILES

CCCCCCCCCCCC1CCC(CC1)C2=CN=C(C=C2)C3=CC=C(C=C3)N=C=S

InChI

InChI=1S/C29H40N2S/c1-2-3-4-5-6-7-8-9-10-11-24-12-14-25(15-13-24)27-18-21-29(30-22-27)26-16-19-28(20-17-26)31-23-32/h16-22,24-25H,2-15H2,1H3