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

Systemtic Name: 2-(4-isothiocyanatophenyl)-5-nonyl-pyridine Openeye Name: 2-(4-isothiocyanatophenyl)-5-nonyl-pyridine CAS Name: 2-(4-isothiocyanatophenyl)-5-nonylpyridine IUPAC Name: 2-(4-isothiocyanatophenyl)-5-nonylpyridine Traditional Name: 2-(4-isothiocyanatophenyl)-5-nonyl-pyridine Formula: C21H26N2S MolecularWeight: 338.50954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)N=C=S

Isomeric SMILES

CCCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)N=C=S

InChI

InChI=1S/C21H26N2S/c1-2-3-4-5-6-7-8-9-18-10-15-21(22-16-18)19-11-13-20(14-12-19)23-17-24/h10-16H,2-9H2,1H3