PJP
Summary
Name: | N,N-diethyl-4-methylbenzene-1-sulfonamide |
Formula: | C11 H17 N O2 S |
Formal charge: | 0 |
Formula weight: | 227.323 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N,N-diethyl-4-methylbenzene-1-sulfonamide |
OpenEye OEToolkits | 2.0.6 | ~{N},~{N}-diethyl-4-methyl-benzenesulfonamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | CCN(CC)S(c1ccc(cc1)C)(=O)=O |
InChI | InChI | 1.03 | InChI=1S/C11H17NO2S/c1-4-12(5-2)15(13,14)11-8-6-10(3)7-9-11/h6-9H,4-5H2,1-3H3 |
InChIKey | InChI | 1.03 | AOJBACHWNDMRQP-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCN(CC)[S](=O)(=O)c1ccc(C)cc1 |
SMILES | CACTVS | 3.385 | CCN(CC)[S](=O)(=O)c1ccc(C)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCN(CC)S(=O)(=O)c1ccc(cc1)C |
SMILES | OpenEye OEToolkits | 2.0.6 | CCN(CC)S(=O)(=O)c1ccc(cc1)C |