L0D
Summary
Name: | 2-(1H-pyrazol-3-yl)-1H-benzimidazole |
Formula: | C10 H8 N4 |
Formal charge: | 0 |
Formula weight: | 184.197 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 2-(1H-pyrazol-3-yl)-1H-benzimidazole |
OpenEye OEToolkits | 1.5.0 | 2-(1H-pyrazol-3-yl)-1H-benzimidazole |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | n2c1c(cccc1)nc2c3nncc3 |
SMILES_CANONICAL | CACTVS | 3.341 | [nH]1ccc(n1)c2[nH]c3ccccc3n2 |
SMILES | CACTVS | 3.341 | [nH]1ccc(n1)c2[nH]c3ccccc3n2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)[nH]c(n2)c3cc[nH]n3 |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)[nH]c(n2)c3cc[nH]n3 |
InChI | InChI | 1.03 | InChI=1S/C10H8N4/c1-2-4-8-7(3-1)12-10(13-8)9-5-6-11-14-9/h1-6H,(H,11,14)(H,12,13) |
InChIKey | InChI | 1.03 | IYTGPPNUOLLGBE-UHFFFAOYSA-N |