V21
Summary
Name: | 3-methylthiobenzimidazo[1,2-c][1,2,3]thiadiazol-7-sulfonamide |
Formula: | C9 H8 N4 O2 S3 |
Formal charge: | 0 |
Formula weight: | 300.38 Da |
Component type: | NON-POLYMER |
Ambiguous Chemistry Warning: | The chemical description of this component is not well described in this definition. Descriptors and chemical names should be used with caution. |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES_CANONICAL | CACTVS | 3.341 | CSC1=[S]=Nn2c3cc(ccc3nc12)[S](N)(=O)=O |
SMILES | CACTVS | 3.341 | CSC1=[S]=Nn2c3cc(ccc3nc12)[S](N)(=O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CSC1=S=Nn2c1nc3c2cc(cc3)S(=O)(=O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | CSC1=S=Nn2c1nc3c2cc(cc3)S(=O)(=O)N |
InChI | InChI | 1.03 | InChI=1S/C9H8N4O2S3/c1-16-9-8-11-6-3-2-5(18(10,14)15)4-7(6)13(8)12-17-9/h2-4H,1H3,(H2,10,14,15) |
InChIKey | InChI | 1.03 | RQMLRBLXFGMTFD-UHFFFAOYSA-N |