ZJZ
Summary
| Name: | 7-(2-azanyl-5-chloranyl-phenyl)-3$l^{3}-thia-5,6$l^{4}-diaza-2$l^{3}-platinatricyclo[6.4.0.0^{2,6}]dodeca-1(12),3,6,8,10-pentaen-4-amine |
| Formula: | C14 H12 Cl N4 Pt S |
| Formal charge: | 0 |
| Formula weight: | 498.868 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 7-(2-azanyl-5-chloranyl-phenyl)-3$l^{3}-thia-5,6$l^{4}-diaza-2$l^{3}-platinatricyclo[6.4.0.0^{2,6}]dodeca-1(12),3,6,8,10-pentaen-4-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H12ClN4S.Pt/c15-10-6-7-12(16)11(8-10)13(18-19-14(17)20)9-4-2-1-3-5-9;/h1-4,6-8H,16H2,(H3,17,19,20);/b18-13-; |
| InChIKey | InChI | 1.06 | QEUVFWYAJJGIQM-AAKIMCHBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=S)NN=C(c1cc(Cl)ccc1N)c2ccccc2[Pt] |
| SMILES | CACTVS | 3.385 | NC(=S)NN=C(c1cc(Cl)ccc1N)c2ccccc2[Pt] |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)C(=[N]3[Pt]2[S]=C(N3)N)c4cc(ccc4N)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)C(=[N]3[Pt]2[S]=C(N3)N)c4cc(ccc4N)Cl |
