Basic information
- Standard SMILES
C#CCON=C(C(=O)OCC)c1csc(N)n1- InChIKey
IBBFCLMPRISSNU-UHFFFAOYSA-N- Molecular formula
- C10H11N3O3S
- Average molar mass
- 253.28 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-(2-aminothiazol-4-yl)-2-propargyloxyiminoacetate
- IUPAC
- ethyl 2-(2-amino-1,3-thiazol-4-yl)-2-prop-2-ynoxyiminoacetate
Names & synonyms
SCHEMBL10417828IBBFCLMPRISSNU-UHFFFAOYSA-Nethyl 2-(2-aminothiazol-4-yl)-2-propargyloxyiminoacetate
Database identifiers
- PubChem CID
- 53907014
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 350
Related reactions
48 records
Compound notes
Loading…