TIU
Summary
Name: | tricarbonodiimidic diamide |
Formula: | C3 H6 N4 O3 |
Formal charge: | 0 |
Formula weight: | 146.105 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | tricarbonodiimidic diamide |
OpenEye OEToolkits | 2.0.7 | 1,3-diaminocarbonylurea |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | NC(NC(=O)NC(N)=O)=O |
InChI | InChI | 1.03 | InChI=1S/C3H6N4O3/c4-1(8)6-3(10)7-2(5)9/h(H6,4,5,6,7,8,9,10) |
InChIKey | InChI | 1.03 | WNVQBUHCOYRLPA-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)NC(=O)NC(N)=O |
SMILES | CACTVS | 3.385 | NC(=O)NC(=O)NC(N)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C(=O)(N)NC(=O)NC(=O)N |
SMILES | OpenEye OEToolkits | 2.0.7 | C(=O)(N)NC(=O)NC(=O)N |