carbanide; 2-ditert-butylphosphaniumyl-1-(4-dimethylaminophenyl)-1-(4-methylphenyl)ethanethiolate; nickel(2+)

Systemtic Name: carbanide; 2-ditert-butylphosphaniumyl-1-(4-dimethylaminophenyl)-1-(4-methylphenyl)ethanethiolate; nickel(2+) Openeye Name: nickelous; carbanide; 2-ditert-butylphosphaniumyl-1-(4-dimethylaminophenyl)-1-(p-tolyl)ethanethiolate CAS Name: carbanide; 2-ditert-butylphosphiniumyl-1-(4-dimethylaminophenyl)-1-(4-methylphenyl)ethanethiolate; nickel(2+) IUPAC Name: carbanide; 2-ditert-butylphosphaniumyl-1-(4-dimethylaminophenyl)-1-(4-methylphenyl)ethanethiolate; nickel(2+) Traditional Name: nickelous; carbanide; 2-ditert-butylphosphiniumyl-1-(4-dimethylaminophenyl)-1-(p-tolyl)ethanethiolate Formula: C26H41NNiPS+ MolecularWeight: 489.342601

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].CC1=CC=C(C=C1)C(C[PH+](C(C)(C)C)C(C)(C)C)(C2=CC=C(C=C2)N(C)C)[S-].[Ni+2]

Isomeric SMILES

[CH3-].CC1=CC=C(C=C1)C(C[PH+](C(C)(C)C)C(C)(C)C)(C2=CC=C(C=C2)N(C)C)[S-].[Ni+2]

InChI

InChI=1S/C25H38NPS.CH3.Ni/c1-19-10-12-20(13-11-19)25(28,18-27(23(2,3)4)24(5,6)7)21-14-16-22(17-15-21)26(8)9;;/h10-17,28H,18H2,1-9H3;1H3;/q;-1;+2