AC1M2U22
ethyl 4,5-dimethyl-2-[[2-[(5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate
Also Known As: F3394-0741|ETHYL 4,5-DIMETHYL-2-[2-({5-PHENYL-[1,2,4]TRIAZOLO[3,4-B][1,3]THIAZOL-3-YL}SULFANYL)ACETAMIDO]THIOPHENE-3-CARBOXYLATE|ethyl 4,5-dimethyl-2-(2-((5-phenylthiazolo[2,3-c][1,2,4]triazol-3-yl)thio)acetamido)thiophene-3-carboxylate|ethyl 4,5-dimethyl-2-[[2-[(5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate|ethyl 4,5-dimethyl-2-{[(8-phenyl-6-thia-1,3,4-triazabicyclo[3.3.0]octa-2,4,7-trien-2-ylthio)methyl]carbonylamino}-3-thenoate
| Molecular Formula | C21H20N4O3S3 |
|---|---|
| Molecular Weight | 472.06976 g/mol |
| LogP | 5.04364 |
| Topological Polar Surface Area | 85.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 472.06976 |
| Monoisotopic Mass | 472.06976 |
| Heavy Atoms | 31 |
| Complexity | 1243.772 |
Chemical Identifiers
| CAS Number | 690961-67-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NN=C3N2C(=CS3)C4=CC=CC=C4 |
Product Overview
AC1M2U22 (CAS 690961-67-2), with molecular formula C21H20N4O3S3 and molecular weight 472.06976 g/mol. IUPAC: ethyl 4,5-dimethyl-2-[[2-[(5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate.
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