3C2
Summary
Name: | 4-ethyl-3,4-dihydro-2H-pyrido[3,2-e][1,2,4]thiadiazine 1,1-dioxide |
Formula: | C8 H11 N3 O2 S |
Formal charge: | 0 |
Formula weight: | 213.257 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 4-ethyl-3,4-dihydro-2H-pyrido[3,2-e][1,2,4]thiadiazine 1,1-dioxide |
OpenEye OEToolkits | 1.9.2 | 4-ethyl-2,3-dihydropyrido[3,2-e][1,2,4]thiadiazine 1,1-dioxide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=S2(=O)c1ncccc1N(CN2)CC |
InChI | InChI | 1.03 | InChI=1S/C8H11N3O2S/c1-2-11-6-10-14(12,13)8-7(11)4-3-5-9-8/h3-5,10H,2,6H2,1H3 |
InChIKey | InChI | 1.03 | YUNAWRDISADKIN-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCN1CN[S](=O)(=O)c2ncccc12 |
SMILES | CACTVS | 3.385 | CCN1CN[S](=O)(=O)c2ncccc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CCN1CNS(=O)(=O)c2c1cccn2 |
SMILES | OpenEye OEToolkits | 1.9.2 | CCN1CNS(=O)(=O)c2c1cccn2 |