5Q5
Summary
| Name: | 1-(2-methylphenyl)thiourea |
| Formula: | C8 H10 N2 S |
| Formal charge: | 0 |
| Formula weight: | 166.243 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.4 | 1-(2-methylphenyl)thiourea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C8H10N2S/c1-6-4-2-3-5-7(6)10-8(9)11/h2-5H,1H3,(H3,9,10,11) |
| InChIKey | InChI | 1.03 | ACLZYRNSDLQOIA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccccc1NC(N)=S |
| SMILES | CACTVS | 3.385 | Cc1ccccc1NC(N)=S |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | Cc1ccccc1NC(=S)N |
| SMILES | OpenEye OEToolkits | 2.0.4 | Cc1ccccc1NC(=S)N |
