chloranylcopper(1+); N'-[(E)-(3-methyl-4-oxidanyl-2-oxidanylidene-naphthalen-1-ylidene)amino]carbamimidothioate

Systemtic Name: chloranylcopper(1+); N'-[(E)-(3-methyl-4-oxidanyl-2-oxidanylidene-naphthalen-1-ylidene)amino]carbamimidothioate Openeye Name: chlorocopper(1+); N'-[(E)-(4-hydroxy-3-methyl-2-oxo-1-naphthylidene)amino]carbamimidothioate CAS Name: chlorocopper(1+); N'-[(E)-(4-hydroxy-3-methyl-2-oxo-1-naphthalenylidene)amino]carbamimidothioate IUPAC Name: chlorocopper(1+); N'-[(E)-(4-hydroxy-3-methyl-2-oxonaphthalen-1-ylidene)amino]carbamimidothioate Traditional Name: chlorocopper(1+); N'-[(E)-(4-hydroxy-2-keto-3-methyl-1-naphthylidene)amino]carbamimidothioate Formula: C12H10ClCuN3O2S MolecularWeight: 359.2907

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C(=NN=C(N)[S-])C1=O)O.Cl[Cu+]

Isomeric SMILES

CC1=C(C2=CC=CC=C2/C(=N\N=C(\N)/[S-])/C1=O)O.Cl[Cu+]

InChI

InChI=1S/C12H11N3O2S.ClH.Cu/c1-6-10(16)8-5-3-2-4-7(8)9(11(6)17)14-15-12(13)18;;/h2-5,16H,1H3,(H3,13,15,18);1H;/q;;+2/p-2/b14-9+;;