B5H
Summary
| Name: | (5Z)-5-[(3-bromophenyl)methylidene]imidazolidine-2,4-dione |
| Formula: | C10 H7 Br N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 267.079 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (5Z)-5-(3-bromobenzylidene)imidazolidine-2,4-dione |
| OpenEye OEToolkits | 1.7.6 | (5Z)-5-[(3-bromophenyl)methylidene]imidazolidine-2,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2NC(=C\c1cc(Br)ccc1)/C(=O)N2 |
| InChI | InChI | 1.03 | InChI=1S/C10H7BrN2O2/c11-7-3-1-2-6(4-7)5-8-9(14)13-10(15)12-8/h1-5H,(H2,12,13,14,15)/b8-5- |
| InChIKey | InChI | 1.03 | CFJZPYYYXHXWSB-YVMONPNESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Brc1cccc(c1)\C=C2/NC(=O)NC2=O |
| SMILES | CACTVS | 3.385 | Brc1cccc(c1)C=C2NC(=O)NC2=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(cc(c1)Br)/C=C\2/C(=O)NC(=O)N2 |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(cc(c1)Br)C=C2C(=O)NC(=O)N2 |
