EM5
Summary
| Name: | 4-chloranyl-2-(cyclohexylamino)-~{N}-(2-hydroxyethyl)-5-sulfamoyl-benzamide |
| Formula: | C15 H22 Cl N3 O4 S |
| Formal charge: | 0 |
| Formula weight: | 375.871 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 4-chloranyl-2-(cyclohexylamino)-~{N}-(2-hydroxyethyl)-5-sulfamoyl-benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H22ClN3O4S/c16-12-9-13(19-10-4-2-1-3-5-10)11(15(21)18-6-7-20)8-14(12)24(17,22)23/h8-10,19-20H,1-7H2,(H,18,21)(H2,17,22,23) |
| InChIKey | InChI | 1.03 | MDLHQNNKYAWRKZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[S](=O)(=O)c1cc(C(=O)NCCO)c(NC2CCCCC2)cc1Cl |
| SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1cc(C(=O)NCCO)c(NC2CCCCC2)cc1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1c(c(cc(c1S(=O)(=O)N)Cl)NC2CCCCC2)C(=O)NCCO |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1c(c(cc(c1S(=O)(=O)N)Cl)NC2CCCCC2)C(=O)NCCO |
