2-hexylsulfanyl-5-isothiocyanato-pyridine

Systemtic Name: 2-hexylsulfanyl-5-isothiocyanato-pyridine Openeye Name: 2-hexylsulfanyl-5-isothiocyanato-pyridine CAS Name: 2-(hexylthio)-5-isothiocyanatopyridine IUPAC Name: 2-hexylsulfanyl-5-isothiocyanatopyridine Traditional Name: 2-(hexylthio)-5-isothiocyanato-pyridine Formula: C12H16N2S2 MolecularWeight: 252.39884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC=C(C=C1)N=C=S

Isomeric SMILES

CCCCCCSC1=NC=C(C=C1)N=C=S

InChI

InChI=1S/C12H16N2S2/c1-2-3-4-5-8-16-12-7-6-11(9-13-12)14-10-15/h6-7,9H,2-5,8H2,1H3