carbanide; 5-(methylideneamino)-2-[(2-oxidanyl-6-sulfanyloxyperoxy-naphthalen-1-yl)iminomethylideneamino]imidazol-3-ide-4-carbonitrile; nickel; 2-[(2-oxidanyl-6-sulfanyloxyperoxy-naphthalen-1-yl)iminomethylideneamino]imidazol-3-ide-4,5-dicarbonitrile

Systemtic Name: carbanide; 5-(methylideneamino)-2-[(2-oxidanyl-6-sulfanyloxyperoxy-naphthalen-1-yl)iminomethylideneamino]imidazol-3-ide-4-carbonitrile; nickel; 2-[(2-oxidanyl-6-sulfanyloxyperoxy-naphthalen-1-yl)iminomethylideneamino]imidazol-3-ide-4,5-dicarbonitrile Openeye Name: carbanide; 2-[(2-hydroxy-6-sulfanyloxyperoxy-1-naphthyl)iminomethyleneamino]imidazol-3-ide-4,5-dicarbonitrile; 2-[(2-hydroxy-6-sulfanyloxyperoxy-1-naphthyl)iminomethyleneamino]-5-(methyleneamino)imidazol-3-ide-4-carbonitrile; nickel CAS Name: carbanide; 2-[(2-hydroxy-6-mercaptooxydioxy-1-naphthalenyl)iminomethylideneamino]imidazol-3-ide-4,5-dicarbonitrile; 2-[(2-hydroxy-6-mercaptooxydioxy-1-naphthalenyl)iminomethylideneamino]-5-(methyleneamino)-4-imidazol-3-idecarbonitrile; nickel IUPAC Name: carbanide; 2-[(2-hydroxy-6-sulfanyloxyperoxynaphthalen-1-yl)iminomethylideneamino]imidazol-3-ide-4,5-dicarbonitrile; 2-[(2-hydroxy-6-sulfanyloxyperoxynaphthalen-1-yl)iminomethylideneamino]-5-(methylideneamino)imidazol-3-ide-4-carbonitrile; nickel Traditional Name: carbanide; 2-[(2-hydroxy-6-mercaptooxyperoxy-1-naphthyl)iminomethyleneamino]imidazol-3-ide-4,5-dicarbonitrile; 2-[(2-hydroxy-6-mercaptooxyperoxy-1-naphthyl)iminomethyleneamino]-5-(methyleneamino)imidazol-3-ide-4-carbonitrile; nickel Formula: C34H22N12NiO8S2-4 MolecularWeight: 849.43748

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].C=NC1=C([N-]C(=N1)N=C=NC2=C(C=CC3=C2C=CC(=C3)OOOS)O)C#N.C1=CC2=C(C=CC(=C2N=C=NC3=NC(=C([N-]3)C#N)C#N)O)C=C1OOOS.[Ni]

Isomeric SMILES

[CH3-].[CH3-].C=NC1=C([N-]C(=N1)N=C=NC2=C(C=CC3=C2C=CC(=C3)OOOS)O)C#N.C1=CC2=C(C=CC(=C2N=C=NC3=NC(=C([N-]3)C#N)C#N)O)C=C1OOOS.[Ni]

InChI

InChI=1S/C16H9N6O4S.C16H7N6O4S.2CH3.Ni/c1-18-15-12(7-17)21-16(22-15)20-8-19-14-11-4-3-10(24-25-26-27)6-9(11)2-5-13(14)23;17-6-12-13(7-18)22-16(21-12)20-8-19-15-11-3-2-10(24-25-26-27)5-9(11)1-4-14(15)23;;;/h2-6H,1H2,(H2-,21,22,23,27);1-5H,(H2-,21,22,23,27);2*1H3;/q4*-1;