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

Systemtic Name: 2-(4-isothiocyanatophenyl)-5-octyl-pyridine Openeye Name: 2-(4-isothiocyanatophenyl)-5-octyl-pyridine CAS Name: 2-(4-isothiocyanatophenyl)-5-octylpyridine IUPAC Name: 2-(4-isothiocyanatophenyl)-5-octylpyridine Traditional Name: 2-(4-isothiocyanatophenyl)-5-octyl-pyridine Formula: C20H24N2S MolecularWeight: 324.48296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)N=C=S

Isomeric SMILES

CCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)N=C=S

InChI

InChI=1S/C20H24N2S/c1-2-3-4-5-6-7-8-17-9-14-20(21-15-17)18-10-12-19(13-11-18)22-16-23/h9-15H,2-8H2,1H3