nickel(2+); 2-[(phenylmethyl)iminomethyl]-1-benzofuran-3-thiolate

Systemtic Name: nickel(2+); 2-[(phenylmethyl)iminomethyl]-1-benzofuran-3-thiolate Openeye Name: nickelous 2-(benzyliminomethyl)benzofuran-3-thiolate CAS Name: nickel(2+); 2-[(phenylmethyl)iminomethyl]-3-benzofuranthiolate IUPAC Name: 2-(benzyliminomethyl)-1-benzofuran-3-thiolate; nickel(2+) Traditional Name: nickelous 2-(benzyliminomethyl)benzofuran-3-thiolate Formula: C32H24N2NiO2S2 MolecularWeight: 591.36856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN=CC2=C(C3=CC=CC=C3O2)[S-].C1=CC=C(C=C1)CN=CC2=C(C3=CC=CC=C3O2)[S-].[Ni+2]

Isomeric SMILES

C1=CC=C(C=C1)CN=CC2=C(C3=CC=CC=C3O2)[S-].C1=CC=C(C=C1)CN=CC2=C(C3=CC=CC=C3O2)[S-].[Ni+2]

InChI

InChI=1S/2C16H13NOS.Ni/c2*19-16-13-8-4-5-9-14(13)18-15(16)11-17-10-12-6-2-1-3-7-12;/h2*1-9,11,19H,10H2;/q;;+2/p-2