| CAS Number | 93029-92-6 |
| Catalog Number | AG01A91G(AGN-PC-003IXW) |
| Chemical Name | N-(3-carbamothioylphenyl)acetamide |
| IUPAC Name | N-(3-carbamothioylphenyl)acetamide |
| InChI | InChI=1S/C9H10N2OS/c1-6(12)11-8-4-2-3-7(5-8)9(10)13/h2-5H,1H3,(H2,10,13)(H,11,12) |
| InChI Key | BAKXWEATJHSISZ-UHFFFAOYSA-N |
| MDL Number | MFCD09939039 |
| Molecular Formula | C9H10N2OS |
| Molecular Weight | 194.2535 |
| SMILES | CC(NC1=CC(C(N)=S)=CC=C1)=O |
| Synonyms | N-(3-carbamothioylphenyl)acetamide,
3-acetylaminothiobenzamide,
93029-92-6,
AC1Q1KM9,
ZINC19479531,
AKOS000179942,
MCULE-8314671045,
NE26700,
EN300-63976,
|
| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.252g/mol |
| Monoisotopic Mass | 194.051g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 87.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number