UVG
Summary
Name: | N,N-dimethyl-1H-pyrazole-4-carboxamide |
Formula: | C6 H9 N3 O |
Formal charge: | 0 |
Formula weight: | 139.155 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N,N-dimethyl-1H-pyrazole-4-carboxamide |
OpenEye OEToolkits | 2.0.7 | ~{N},~{N}-dimethyl-1~{H}-pyrazole-4-carboxamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | n1ncc(c1)C(N(C)C)=O |
InChI | InChI | 1.03 | InChI=1S/C6H9N3O/c1-9(2)6(10)5-3-7-8-4-5/h3-4H,1-2H3,(H,7,8) |
InChIKey | InChI | 1.03 | XHOFWFVNVHZGMB-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN(C)C(=O)c1c[nH]nc1 |
SMILES | CACTVS | 3.385 | CN(C)C(=O)c1c[nH]nc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(C)C(=O)c1c[nH]nc1 |
SMILES | OpenEye OEToolkits | 2.0.7 | CN(C)C(=O)c1c[nH]nc1 |