2-Butenediamide, N-methyl-N'-(1,3,4-thiadiazol-2-yl)-
Basic information
- CAS
90278-96-9- Standard SMILES
CNC(=O)/C=C/C(=O)Nc1nncs1- InChIKey
VHWZUVQQMVIOEZ-NSCUHMNNSA-N- Molecular formula
- C7H8N4O2S
- Average molar mass
- 212.23 g/mol
- Monoisotopic mass
- 212.03679668
Names & identifiers
- Preferred name
- 2-Butenediamide, N-methyl-N'-(1,3,4-thiadiazol-2-yl)-
- IUPAC
- (E)-N-methyl-N'-(1,3,4-thiadiazol-2-yl)but-2-enediamide
Names & synonyms
2-BUTENEDIAMIDE, N-METHYL-N'-(1,3,4-THIADIAZOL-2-YL)-90278-96-9RefChem:1062581N-Methyl-N'-(1,3,4-thiadiazol-2-yl)-2-butenediamide
Database identifiers
- CAS
90278-96-9- PubChem CID
- 6435477
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 256
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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