A1JFK
Summary
| Name: | (2~{R})-2-[4-(2-methylpropyl)phenyl]-~{N}-(2-sulfamoylethyl)propanamide |
| Formula: | C15 H24 N2 O3 S |
| Formal charge: | 0 |
| Formula weight: | 312.428 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{R})-2-[4-(2-methylpropyl)phenyl]-~{N}-(2-sulfamoylethyl)propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C15H24N2O3S/c1-11(2)10-13-4-6-14(7-5-13)12(3)15(18)17-8-9-21(16,19)20/h4-7,11-12H,8-10H2,1-3H3,(H,17,18)(H2,16,19,20)/t12-/m1/s1 |
| InChIKey | InChI | 1.06 | FDWMQXOAKMHLQU-GFCCVEGCSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)Cc1ccc(cc1)[C@@H](C)C(=O)NCC[S](N)(=O)=O |
| SMILES | CACTVS | 3.385 | CC(C)Cc1ccc(cc1)[CH](C)C(=O)NCC[S](N)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@H](c1ccc(cc1)CC(C)C)C(=O)NCCS(=O)(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)Cc1ccc(cc1)C(C)C(=O)NCCS(=O)(=O)N |
