8K5
Summary
| Name: | [azanyl-[(4-chlorophenyl)methylsulfanyl]methylidene]azanium |
| Formula: | C8 H10 Cl N2 S |
| Formal charge: | 1 |
| Formula weight: | 201.696 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | [azanyl-[(4-chlorophenyl)methylsulfanyl]methylidene]azanium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C8H9ClN2S/c9-7-3-1-6(2-4-7)5-12-8(10)11/h1-4H,5H2,(H3,10,11)/p+1 |
| InChIKey | InChI | 1.03 | YOCWIHYZDHPSHD-UHFFFAOYSA-O |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=[NH2+])SCc1ccc(Cl)cc1 |
| SMILES | CACTVS | 3.385 | NC(=[NH2+])SCc1ccc(Cl)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1CSC(=[NH2+])N)Cl |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1CSC(=[NH2+])N)Cl |
