RZ0
N-butyl-4-sulfamoylbenzamide
| Created: | 2011-05-16 |
| Last modified: | 2011-06-04 |
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Chemical Details | |
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| Formal Charge | 0 |
| Atom Count | 33 |
| Chiral Atom Count | 0 |
| Bond Count | 33 |
| Aromatic Bond Count | 6 |
Chemical Component Summary | |
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| Name | N-butyl-4-sulfamoylbenzamide |
| Systematic Name (OpenEye OEToolkits) | N-butyl-4-sulfamoyl-benzamide |
| Formula | C11 H16 N2 O3 S |
| Molecular Weight | 256.321 |
| Type | NON-POLYMER |
Chemical Descriptors | |||
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| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=S(=O)(N)c1ccc(C(=O)NCCCC)cc1 |
| SMILES | CACTVS | 3.370 | CCCCNC(=O)c1ccc(cc1)[S](N)(=O)=O |
| SMILES | OpenEye OEToolkits | 1.7.2 | CCCCNC(=O)c1ccc(cc1)S(=O)(=O)N |
| Canonical SMILES | CACTVS | 3.370 | CCCCNC(=O)c1ccc(cc1)[S](N)(=O)=O |
| Canonical SMILES | OpenEye OEToolkits | 1.7.2 | CCCCNC(=O)c1ccc(cc1)S(=O)(=O)N |
| InChI | InChI | 1.03 | InChI=1S/C11H16N2O3S/c1-2-3-8-13-11(14)9-4-6-10(7-5-9)17(12,15)16/h4-7H,2-3,8H2,1H3,(H,13,14)(H2,12,15,16) |
| InChIKey | InChI | 1.03 | QBMVMGJMEIVTPO-UHFFFAOYSA-N |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 10355056 |
| ChEMBL | CHEMBL75131 |














