OA1
Summary
| Name: | (2-AMINO-1,3-OXAZOL-5-YL)-(3-BROMOPHENYL)METHANONE |
| Formula: | C10 H7 Br N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 267.079 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2-amino-1,3-oxazol-5-yl)(3-bromophenyl)methanone |
| OpenEye OEToolkits | 1.6.1 | (2-amino-1,3-oxazol-5-yl)-(3-bromophenyl)methanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(c1cccc(Br)c1)c2oc(nc2)N |
| SMILES_CANONICAL | CACTVS | 3.352 | Nc1oc(cn1)C(=O)c2cccc(Br)c2 |
| SMILES | CACTVS | 3.352 | Nc1oc(cn1)C(=O)c2cccc(Br)c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | c1cc(cc(c1)Br)C(=O)c2cnc(o2)N |
| SMILES | OpenEye OEToolkits | 1.6.1 | c1cc(cc(c1)Br)C(=O)c2cnc(o2)N |
| InChI | InChI | 1.03 | InChI=1S/C10H7BrN2O2/c11-7-3-1-2-6(4-7)9(14)8-5-13-10(12)15-8/h1-5H,(H2,12,13) |
| InChIKey | InChI | 1.03 | YDCMMVTWXORJGO-UHFFFAOYSA-N |
