0TE
Summary
| Name: | (T-4-R)-chlorido{methyl 2-[(pyridin-2-yl)(pyridin-2-yl-kappaN)methylidene]hydrazine-1-carbodithioato-kappa~2~N~2~,S'}copper |
| Formula: | C13 H12 Cl Cu N4 S2 |
| Formal charge: | null |
| Formula weight: | 387.39 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | (T-4-R)-chlorido{methyl 2-[(pyridin-2-yl)(pyridin-2-yl-kappaN)methylidene]hydrazine-1-carbodithioato-kappa~2~N~2~,S'}copper |
| OpenEye OEToolkits | 3.1.0.0 | 2-chloranyl-4-methylsulfanyl-7-pyridin-2-yl-3$l^{3}-thia-1$l^{4},5,6$l^{4}-triaza-2$l^{4}-cupratricyclo[6.4.0.0^{2,6}]dodeca-1(8),3,6,9,11-pentaene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | CSC=1NN2=C(c3ccccn3[Cu]2(Cl)S=1)c1ccccn1 |
| InChI | InChI | 1.06 | InChI=1S/C13H12N4S2.ClH.Cu/c1-19-13(18)17-16-12(10-6-2-4-8-14-10)11-7-3-5-9-15-11;;/h2-9H,1H3,(H,17,18);1H;/q;;+1/p-1 |
| InChIKey | InChI | 1.06 | HIICYICRIXTSNL-UHFFFAOYSA-M |
| SMILES_CANONICAL | CACTVS | 3.385 | CSC(=S)NN=C(c1ccccn1)c2ccccn2.Cl[Cu] |
| SMILES | CACTVS | 3.385 | CSC(=S)NN=C(c1ccccn1)c2ccccn2.Cl[Cu] |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CSC1=[S][Cu]2([N]3=C(C=CC=C3)C(=[N]2N1)c4ccccn4)Cl |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CSC1=[S][Cu]2([N]3=C(C=CC=C3)C(=[N]2N1)c4ccccn4)Cl |
