UH3
Summary
| Name: | (3~{Z})-3-[(4-methyl-1~{H}-imidazol-5-yl)methylidene]-2-oxidanylidene-1~{H}-indole-5-carboxamide |
| Formula: | C14 H12 N4 O2 |
| Formal charge: | 0 |
| Formula weight: | 268.271 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (3~{Z})-3-[(4-methyl-1~{H}-imidazol-5-yl)methylidene]-2-oxidanylidene-1~{H}-indole-5-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H12N4O2/c1-7-12(17-6-16-7)5-10-9-4-8(13(15)19)2-3-11(9)18-14(10)20/h2-6H,1H3,(H2,15,19)(H,16,17)(H,18,20) |
| InChIKey | InChI | 1.06 | NQRCNELXESTXEP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1nc[nH]c1\C=C2/C(=O)Nc3ccc(cc23)C(N)=O |
| SMILES | CACTVS | 3.385 | Cc1nc[nH]c1C=C2C(=O)Nc3ccc(cc23)C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1c([nH]cn1)/C=C\2/c3cc(ccc3NC2=O)C(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1c([nH]cn1)C=C2c3cc(ccc3NC2=O)C(=O)N |
