[azepan-1-yl(sulfaniumylidene)methyl]-(1-pyridin-2-ylethylideneamino)azanide; nickel; thiocyanate

Systemtic Name: [azepan-1-yl(sulfaniumylidene)methyl]-(1-pyridin-2-ylethylideneamino)azanide; nickel; thiocyanate Openeye Name: [azepan-1-yl(sulfoniumylidene)methyl]-[1-(2-pyridyl)ethylideneamino]azanide; nickel; thiocyanate CAS Name: [1-azepanyl(sulfoniumylidene)methyl]-[1-(2-pyridinyl)ethylideneamino]azanide; nickel; thiocyanate IUPAC Name: [azepan-1-yl(sulfoniumylidene)methyl]-(1-pyridin-2-ylethylideneamino)azanide; nickel; thiocyanate Traditional Name: [azepan-1-yl(sulfoniumylidene)methyl]-[1-(2-pyridyl)ethylideneamino]azanide; nickel; thiocyanate Formula: C15H20N5NiS2- MolecularWeight: 393.1762

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N[N-]C(=[SH+])N1CCCCCC1)C2=CC=CC=N2.C(#N)[S-].[Ni]

Isomeric SMILES

CC(=N[N-]C(=[SH+])N1CCCCCC1)C2=CC=CC=N2.C(#N)[S-].[Ni]

InChI

InChI=1S/C14H20N4S.CHNS.Ni/c1-12(13-8-4-5-9-15-13)16-17-14(19)18-10-6-2-3-7-11-18;2-1-3;/h4-5,8-9H,2-3,6-7,10-11H2,1H3,(H,15,17,19);3H;/p-1