chloranylcobalt(1+); 4-phenyldiazenyl-2-[2-(2-pyridin-2-ylethylsulfanyl)ethyliminomethyl]phenolate

Systemtic Name: chloranylcobalt(1+); 4-phenyldiazenyl-2-[2-(2-pyridin-2-ylethylsulfanyl)ethyliminomethyl]phenolate Openeye Name: chlorocobalt(1+); 4-phenylazo-2-[2-[2-(2-pyridyl)ethylsulfanyl]ethyliminomethyl]phenolate CAS Name: chlorocobalt(1+); 4-phenyldiazenyl-2-[2-[2-(2-pyridinyl)ethylthio]ethyliminomethyl]phenolate IUPAC Name: chlorocobalt(1+); 4-phenyldiazenyl-2-[2-(2-pyridin-2-ylethylsulfanyl)ethyliminomethyl]phenolate Traditional Name: chlorocobalt(1+); 4-phenylazo-2-[2-[2-(2-pyridyl)ethylthio]ethyliminomethyl]phenolate Formula: C22H21ClCoN4OS MolecularWeight: 483.87954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC(=C(C=C2)[O-])C=NCCSCCC3=CC=CC=N3.Cl[Co+]

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC(=C(C=C2)[O-])C=NCCSCCC3=CC=CC=N3.Cl[Co+]

InChI

InChI=1S/C22H22N4OS.ClH.Co/c27-22-10-9-21(26-25-20-7-2-1-3-8-20)16-18(22)17-23-13-15-28-14-11-19-6-4-5-12-24-19;;/h1-10,12,16-17,27H,11,13-15H2;1H;/q;;+2/p-2