O5N
Summary
| Name: | 1-[2-[(2-fluorophenyl)methylamino]ethyl]-3-(3-sulfamoylphenyl)urea |
| Formula: | C16 H19 F N4 O3 S |
| Formal charge: | 0 |
| Formula weight: | 366.41 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1-[2-[(2-fluorophenyl)methylamino]ethyl]-3-(3-sulfamoylphenyl)urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H19FN4O3S/c17-15-7-2-1-4-12(15)11-19-8-9-20-16(22)21-13-5-3-6-14(10-13)25(18,23)24/h1-7,10,19H,8-9,11H2,(H2,18,23,24)(H2,20,21,22) |
| InChIKey | InChI | 1.03 | YRJULALGRMXJEX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[S](=O)(=O)c1cccc(NC(=O)NCCNCc2ccccc2F)c1 |
| SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1cccc(NC(=O)NCCNCc2ccccc2F)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)CNCCNC(=O)Nc2cccc(c2)S(=O)(=O)N)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)CNCCNC(=O)Nc2cccc(c2)S(=O)(=O)N)F |
