A1JAA
Summary
| Name: | ~{N}-(5-aminocarbonyl-1~{H}-pyrrol-3-yl)-2-(aminomethyl)-1,3-thiazole-5-carboxamide |
| Formula: | C10 H11 N5 O2 S |
| Formal charge: | 0 |
| Formula weight: | 265.292 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(5-aminocarbonyl-1~{H}-pyrrol-3-yl)-2-(aminomethyl)-1,3-thiazole-5-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H11N5O2S/c11-2-8-14-4-7(18-8)10(17)15-5-1-6(9(12)16)13-3-5/h1,3-4,13H,2,11H2,(H2,12,16)(H,15,17) |
| InChIKey | InChI | 1.06 | AHVSCXNXKFVDHZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCc1sc(cn1)C(=O)Nc2c[nH]c(c2)C(N)=O |
| SMILES | CACTVS | 3.385 | NCc1sc(cn1)C(=O)Nc2c[nH]c(c2)C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c(c[nH]c1C(=O)N)NC(=O)c2cnc(s2)CN |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c(c[nH]c1C(=O)N)NC(=O)c2cnc(s2)CN |
