A1JDL
Summary
| Name: | ~{N}-butyl-4-cyclohexylsulfanyl-3-sulfamoyl-benzamide |
| Formula: | C17 H26 N2 O3 S2 |
| Formal charge: | 0 |
| Formula weight: | 370.53 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-butyl-4-cyclohexylsulfanyl-3-sulfamoyl-benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C17H26N2O3S2/c1-2-3-11-19-17(20)13-9-10-15(16(12-13)24(18,21)22)23-14-7-5-4-6-8-14/h9-10,12,14H,2-8,11H2,1H3,(H,19,20)(H2,18,21,22) |
| InChIKey | InChI | 1.06 | ISNDLQJTGIKBAT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCNC(=O)c1ccc(SC2CCCCC2)c(c1)[S](N)(=O)=O |
| SMILES | CACTVS | 3.385 | CCCCNC(=O)c1ccc(SC2CCCCC2)c(c1)[S](N)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCNC(=O)c1ccc(c(c1)S(=O)(=O)N)SC2CCCCC2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCNC(=O)c1ccc(c(c1)S(=O)(=O)N)SC2CCCCC2 |
