AC1N52HP
4-ethoxy-N-[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: Oprea1_665704|F0417-1431|4-ethoxy-N-[5-({[(1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide|4-ethoxy-N-(5-((2-oxo-2-(thiazol-2-ylamino)ethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide|4-ethoxy-N-[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide|4-ethoxy-N-[5-(1,3-thiazol-2-ylcarbamoylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide|N-{5-[(N-1,3-thiazol-2-ylcarbamoyl)methylthio]-1,3,4-thiadiazol-2-yl}p-ethoxybenzamide
| Molecular Formula | C16H15N5O3S3 |
|---|---|
| Molecular Weight | 421.0337 g/mol |
| LogP | 3.3764 |
| Topological Polar Surface Area | 106.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 421.0337 |
| Monoisotopic Mass | 421.0337 |
| Heavy Atoms | 27 |
| Complexity | 896.43384 |
Chemical Identifiers
| CAS Number | 392299-74-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=NC=CS3 |
Product Overview
AC1N52HP (CAS 392299-74-0), with molecular formula C16H15N5O3S3 and molecular weight 421.0337 g/mol. IUPAC: 4-ethoxy-N-[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
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