A1E6D
Summary
| Name: | Eniporide |
| Formula: | C14 H16 N4 O3 S |
| Formal charge: | 0 |
| Formula weight: | 320.367 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-carbamimidoyl-2-methyl-5-methylsulfonyl-4-pyrrol-1-yl-benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H16N4O3S/c1-9-7-11(18-5-3-4-6-18)12(22(2,20)21)8-10(9)13(19)17-14(15)16/h3-8H,1-2H3,(H4,15,16,17,19) |
| InChIKey | InChI | 1.06 | UADMBZFZZOBWBB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(n2cccc2)c(cc1C(=O)NC(N)=N)[S](C)(=O)=O |
| SMILES | CACTVS | 3.385 | Cc1cc(n2cccc2)c(cc1C(=O)NC(N)=N)[S](C)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | [H]/N=C(\N)/NC(=O)c1cc(c(cc1C)n2cccc2)S(=O)(=O)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(c(cc1C(=O)NC(=N)N)S(=O)(=O)C)n2cccc2 |
