| CAS Number | 949226-45-3 |
| Catalog Number | AG019M4L |
| Chemical Name | 2-(Imidazo[1,2-a]pyridin-2-yl)ethanethioamide |
| IUPAC Name | 2-imidazo[1,2-a]pyridin-2-ylethanethioamide |
| InChI | InChI=1S/C9H9N3S/c10-8(13)5-7-6-12-4-2-1-3-9(12)11-7/h1-4,6H,5H2,(H2,10,13) |
| InChI Key | VTGAXJHIDZMNEU-UHFFFAOYSA-N |
| MDL Number | MFCD09802215 |
| Molecular Formula | C9H9N3S |
| Molecular Weight | 191.2529 |
| SMILES | NC(CC1N=C2N(C=CC=C2)C=1)=S |
| Synonyms | 2-{imidazo[1,2-a]pyridin-2-yl}ethanethioamide,
949226-45-3,
AC1Q500S,
CTK7D3883,
ZINC12506035,
AKOS000199236,
MCULE-8690911535,
NE43569,
EN300-34585,
2-IMIDAZO[1,2-A]PYRIDIN-2-YLETHANETHIOAMIDE,
Z278210514,
Imidazo[1,2-a]pyridine-2-ethanethioamide,
|
| Complexity | 207 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.252g/mol |
| Monoisotopic Mass | 191.052g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 75.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number