2-hexan-3-ylsulfanyl-5-isothiocyanato-pyridine

Systemtic Name: 2-hexan-3-ylsulfanyl-5-isothiocyanato-pyridine Openeye Name: 2-(1-ethylbutylsulfanyl)-5-isothiocyanato-pyridine CAS Name: 2-(hexan-3-ylthio)-5-isothiocyanatopyridine IUPAC Name: 2-hexan-3-ylsulfanyl-5-isothiocyanatopyridine Traditional Name: 2-(1-ethylbutylthio)-5-isothiocyanato-pyridine Formula: C12H16N2S2 MolecularWeight: 252.39884

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)SC1=NC=C(C=C1)N=C=S

Isomeric SMILES

CCCC(CC)SC1=NC=C(C=C1)N=C=S

InChI

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