Z19
1H-indazole-3-carbohydrazide
Created: | 2011-03-25 |
Last modified: | 2011-06-04 |
Find Related PDB Entry |
---|
Find related ligands: |
---|
Chemical Details | |
---|---|
Formal Charge | 0 |
Atom Count | 21 |
Chiral Atom Count | 0 |
Bond Count | 22 |
Aromatic Bond Count | 10 |
Chemical Component Summary | |
---|---|
Name | 1H-indazole-3-carbohydrazide |
Systematic Name (OpenEye OEToolkits) | 1H-indazole-3-carbohydrazide |
Formula | C8 H8 N4 O |
Molecular Weight | 176.175 |
Type | NON-POLYMER |
Chemical Descriptors | |||
---|---|---|---|
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(c2nnc1ccccc12)NN |
SMILES | CACTVS | 3.370 | NNC(=O)c1n[nH]c2ccccc12 |
SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc2c(c1)c(n[nH]2)C(=O)NN |
Canonical SMILES | CACTVS | 3.370 | NNC(=O)c1n[nH]c2ccccc12 |
Canonical SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc2c(c1)c(n[nH]2)C(=O)NN |
InChI | InChI | 1.03 | InChI=1S/C8H8N4O/c9-10-8(13)7-5-3-1-2-4-6(5)11-12-7/h1-4H,9H2,(H,10,13)(H,11,12) |
InChIKey | InChI | 1.03 | JOUPSJAGJHYWLM-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
---|---|
PubChem | 2727853 |