2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethanethiolate; nickel(2+)

Systemtic Name: 2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethanethiolate; nickel(2+) Openeye Name: nickelous 2-(4-methoxyanilino)-2-oxo-ethanethiolate CAS Name: 2-(4-methoxyanilino)-2-oxoethanethiolate; nickel(2+) IUPAC Name: 2-(4-methoxyanilino)-2-oxoethanethiolate; nickel(2+) Traditional Name: nickelous 2-keto-2-(p-anisidino)ethanethiolate Formula: C18H20N2NiO4S2 MolecularWeight: 451.1858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C[S-].COC1=CC=C(C=C1)NC(=O)C[S-].[Ni+2]

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C[S-].COC1=CC=C(C=C1)NC(=O)C[S-].[Ni+2]

InChI

InChI=1S/2C9H11NO2S.Ni/c2*1-12-8-4-2-7(3-5-8)10-9(11)6-13;/h2*2-5,13H,6H2,1H3,(H,10,11);/q;;+2/p-2