3-[(2Z)-2-(6-bromanyl-5-oxidanylidene-pyridin-2-ylidene)hydrazinyl]-1H-1,2,4-triazole-5-carbothialdehyde; carbanide; nickel

Systemtic Name: 3-[(2Z)-2-(6-bromanyl-5-oxidanylidene-pyridin-2-ylidene)hydrazinyl]-1H-1,2,4-triazole-5-carbothialdehyde; carbanide; nickel Openeye Name: 3-[(2Z)-2-(6-bromo-5-oxo-2-pyridylidene)hydrazino]-1H-1,2,4-triazole-5-carbothialdehyde; carbanide; nickel CAS Name: 3-[(2Z)-2-(6-bromo-5-oxo-2-pyridinylidene)hydrazinyl]-1H-1,2,4-triazole-5-carbothioaldehyde; carbanide; nickel IUPAC Name: 3-[(2Z)-2-(6-bromo-5-oxopyridin-2-ylidene)hydrazinyl]-1H-1,2,4-triazole-5-carbothialdehyde; carbanide; nickel Traditional Name: 3-[(N'Z)-N'-(6-bromo-5-keto-2-pyridylidene)hydrazino]-1H-1,2,4-triazole-5-carbothialdehyde; carbanide; nickel Formula: C18H16Br2N12NiO2S2-2 MolecularWeight: 715.03024

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].C1=CC(=NNC2=NNC(=N2)C=S)N=C(C1=O)Br.C1=CC(=NNC2=NNC(=N2)C=S)N=C(C1=O)Br.[Ni]

Isomeric SMILES

[CH3-].[CH3-].C1=C/C(=N/NC2=NNC(=N2)C=S)/N=C(C1=O)Br.C1=C/C(=N/NC2=NNC(=N2)C=S)/N=C(C1=O)Br.[Ni]

InChI

InChI=1S/2C8H5BrN6OS.2CH3.Ni/c2*9-7-4(16)1-2-5(10-7)12-14-8-11-6(3-17)13-15-8;;;/h2*1-3H,(H2,11,13,14,15);2*1H3;/q;;2*-1;/b2*12-5-;;;