zinc 1-butyl-2-sulfanylidene-pyridin-3-olate

Systemtic Name: zinc 1-butyl-2-sulfanylidene-pyridin-3-olate Openeye Name: zinc 1-butyl-2-thioxo-pyridin-3-olate CAS Name: zinc 1-butyl-2-sulfanylidene-3-pyridinolate IUPAC Name: zinc 1-butyl-2-sulfanylidenepyridin-3-olate Traditional Name: zinc 1-butyl-2-thioxo-pyridin-3-olate Formula: C18H24N2O2S2Zn MolecularWeight: 429.93436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CC=C(C1=S)[O-].CCCCN1C=CC=C(C1=S)[O-].[Zn+2]

Isomeric SMILES

CCCCN1C=CC=C(C1=S)[O-].CCCCN1C=CC=C(C1=S)[O-].[Zn+2]

InChI

InChI=1S/2C9H13NOS.Zn/c2*1-2-3-6-10-7-4-5-8(11)9(10)12;/h2*4-5,7,11H,2-3,6H2,1H3;/q;;+2/p-2