NB7
Summary
Name: | N'-[(2-fluorophenyl)sulfonyl]benzohydrazide |
Formula: | C13 H11 F N2 O3 S |
Formal charge: | 0 |
Formula weight: | 294.301 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N'-[(2-fluorophenyl)sulfonyl]benzohydrazide |
OpenEye OEToolkits | 2.0.7 | ~{N}'-(2-fluorophenyl)sulfonylbenzohydrazide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1(ccccc1S(NNC(c2ccccc2)=O)(=O)=O)F |
InChI | InChI | 1.03 | InChI=1S/C13H11FN2O3S/c14-11-8-4-5-9-12(11)20(18,19)16-15-13(17)10-6-2-1-3-7-10/h1-9,16H,(H,15,17) |
InChIKey | InChI | 1.03 | DNZDKRQQOYZLNO-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccccc1[S](=O)(=O)NNC(=O)c2ccccc2 |
SMILES | CACTVS | 3.385 | Fc1ccccc1[S](=O)(=O)NNC(=O)c2ccccc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)C(=O)NNS(=O)(=O)c2ccccc2F |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)C(=O)NNS(=O)(=O)c2ccccc2F |