(Z)-(5-azanylidene-3-methyl-1-phenyl-pyrazol-4-ylidene)-[(4-sulfamoylphenyl)diazenyl]sulfanyl-methanethiolate; chloranylnickel

Systemtic Name: (Z)-(5-azanylidene-3-methyl-1-phenyl-pyrazol-4-ylidene)-[(4-sulfamoylphenyl)diazenyl]sulfanyl-methanethiolate; chloranylnickel Openeye Name: chloronickel; (Z)-(5-imino-3-methyl-1-phenyl-pyrazol-4-ylidene)-(4-sulfamoylphenyl)azosulfanyl-methanethiolate CAS Name: chloronickel; (Z)-(5-imino-3-methyl-1-phenyl-4-pyrazolylidene)-[(4-sulfamoylphenyl)azothio]methanethiolate IUPAC Name: chloronickel; (Z)-(5-imino-3-methyl-1-phenylpyrazol-4-ylidene)-[(4-sulfamoylphenyl)diazenyl]sulfanylmethanethiolate Traditional Name: chloronickel; (Z)-(5-imino-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)-[(4-sulfamoylphenyl)azothio]methanethiolate Formula: C17H15ClN6NiO2S3- MolecularWeight: 525.6814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=N)C1=C([S-])SN=NC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3.Cl[Ni]

Isomeric SMILES

CC\1=NN(C(=N)/C1=C(/[S-])\SN=NC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3.Cl[Ni]

InChI

InChI=1S/C17H16N6O2S3.ClH.Ni/c1-11-15(16(18)23(21-11)13-5-3-2-4-6-13)17(26)27-22-20-12-7-9-14(10-8-12)28(19,24)25;;/h2-10,18,26H,1H3,(H2,19,24,25);1H;/q;;+1/p-2/b17-15-,18-16?,22-20?;;