nickel(2+); (6Z)-6-[(phenylsulfanylamino)methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: nickel(2+); (6Z)-6-[(phenylsulfanylamino)methylidene]cyclohexa-2,4-dien-1-one Openeye Name: nickelous (6Z)-6-[(phenylsulfanylamino)methylene]cyclohexa-2,4-dien-1-one CAS Name: nickel(2+); N-[(Z)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]benzenesulfenamide IUPAC Name: nickel(2+); (6Z)-6-[(phenylsulfanylamino)methylidene]cyclohexa-2,4-dien-1-one Traditional Name: nickelous (6Z)-6-[[(phenylthio)amino]methylene]cyclohexa-2,4-dien-1-one Formula: C26H22N2NiO2S2+2 MolecularWeight: 517.28848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SNC=C2C=CC=CC2=O.C1=CC=C(C=C1)SNC=C2C=CC=CC2=O.[Ni+2]

Isomeric SMILES

C1=CC=C(C=C1)SN/C=C/2\C(=O)C=CC=C2.C1=CC=C(C=C1)SN/C=C/2\C(=O)C=CC=C2.[Ni+2]

InChI

InChI=1S/2C13H11NOS.Ni/c2*15-13-9-5-4-6-11(13)10-14-16-12-7-2-1-3-8-12;/h2*1-10,14H;/q;;+2/b2*11-10-;