copper N-[(2-hydroxyphenyl)carbonylamino]-N'-(phenylcarbonyl)carbamimidothioate thiocyanate

Systemtic Name: copper N-[(2-hydroxyphenyl)carbonylamino]-N'-(phenylcarbonyl)carbamimidothioate thiocyanate Openeye Name: copper N'-benzoyl-N-[(2-hydroxybenzoyl)amino]carbamimidothioate thiocyanate CAS Name: copper N'-benzoyl-N-[[(2-hydroxyphenyl)-oxomethyl]amino]carbamimidothioate thiocyanate IUPAC Name: copper N'-benzoyl-N-[(2-hydroxybenzoyl)amino]carbamimidothioate thiocyanate Traditional Name: cupric N'-benzoyl-N-(salicyloylamino)carbamimidothioate thiocyanate Formula: C16H12CuN4O3S2 MolecularWeight: 435.96748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N=C(NNC(=O)C2=CC=CC=C2O)[S-].C(#N)[S-].[Cu+2]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N=C(NNC(=O)C2=CC=CC=C2O)[S-].C(#N)[S-].[Cu+2]

InChI

InChI=1S/C15H13N3O3S.CHNS.Cu/c19-12-9-5-4-8-11(12)14(21)17-18-15(22)16-13(20)10-6-2-1-3-7-10;2-1-3;/h1-9,19H,(H,17,21)(H2,16,18,20,22);3H;/q;;+2/p-2