copper 2-[(phenylcarbonylcarbamothioylamino)carbamoyl]phenolate thiocyanate

Systemtic Name: copper 2-[(phenylcarbonylcarbamothioylamino)carbamoyl]phenolate thiocyanate Openeye Name: copper 2-[(benzoylcarbamothioylamino)carbamoyl]phenolate thiocyanate CAS Name: copper 2-[[[benzamido(sulfanylidene)methyl]hydrazo]-oxomethyl]phenolate thiocyanate IUPAC Name: copper 2-[(benzoylcarbamothioylamino)carbamoyl]phenolate thiocyanate Traditional Name: cupric 2-[(benzoylthiocarbamoylamino)carbamoyl]phenolate thiocyanate Formula: C16H12CuN4O3S2 MolecularWeight: 435.96748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2[O-].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