OUH
Summary
| Name: | [(2~{S})-2-azanyl-3-(1~{H}-imidazol-5-yl)propyl]carbamic acid |
| Formula: | C7 H12 N4 O2 |
| Formal charge: | 0 |
| Formula weight: | 184.196 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | [(2~{S})-2-azanyl-3-(1~{H}-imidazol-5-yl)propyl]carbamic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C7H12N4O2/c8-5(2-10-7(12)13)1-6-3-9-4-11-6/h3-5,10H,1-2,8H2,(H,9,11)(H,12,13)/t5-/m0/s1 |
| InChIKey | InChI | 1.03 | ARHIBHLYEPIGGS-YFKPBYRVSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@H](CNC(O)=O)Cc1[nH]cnc1 |
| SMILES | CACTVS | 3.385 | N[CH](CNC(O)=O)Cc1[nH]cnc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1c([nH]cn1)C[C@@H](CNC(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1c([nH]cn1)CC(CNC(=O)O)N |
