UCV
Summary
| Name: | 1-[(2~{S})-2-azanyl-3-methyl-butyl]urea |
| Formula: | C6 H15 N3 O |
| Formal charge: | 0 |
| Formula weight: | 145.203 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 1-[(2~{S})-2-azanyl-3-methyl-butyl]urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C6H15N3O/c1-4(2)5(7)3-9-6(8)10/h4-5H,3,7H2,1-2H3,(H3,8,9,10)/t5-/m1/s1 |
| InChIKey | InChI | 1.03 | GGSMGRSJKQIKLL-RXMQYKEDSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)[C@H](N)CNC(N)=O |
| SMILES | CACTVS | 3.385 | CC(C)[CH](N)CNC(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(C)[C@@H](CNC(=O)N)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(C)C(CNC(=O)N)N |
