KJ7
Summary
| Name: | (5S)-5-benzyl-4,5-dihydro-1H-imidazol-2-amine |
| Formula: | C10 H13 N3 |
| Formal charge: | 0 |
| Formula weight: | 175.23 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (5S)-5-benzyl-4,5-dihydro-1H-imidazol-2-amine |
| OpenEye OEToolkits | 2.0.6 | (5~{S})-5-(phenylmethyl)-4,5-dihydro-1~{H}-imidazol-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C=1(N)NC(CN=1)Cc2ccccc2 |
| InChI | InChI | 1.03 | InChI=1S/C10H13N3/c11-10-12-7-9(13-10)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H3,11,12,13)/t9-/m0/s1 |
| InChIKey | InChI | 1.03 | OZKGTJHTWRZQLA-VIFPVBQESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC1=NC[C@H](Cc2ccccc2)N1 |
| SMILES | CACTVS | 3.385 | NC1=NC[CH](Cc2ccccc2)N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)C[C@H]2CN=C(N2)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)CC2CN=C(N2)N |
