AC1NWRU1
ethyl 4-methyl-2-[[2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetyl]amino]-1,3-thiazole-5-carboxylate
Also Known As: Oprea1_011568|SR-01000500428-1|ethyl 2-(2-((5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)acetamido)-4-methylthiazole-5-carboxylate|ETHYL 4-METHYL-2-(2-{5H-[1,2,4]TRIAZINO[5,6-B]INDOL-3-YLSULFANYL}ACETAMIDO)-1,3-THIAZOLE-5-CARBOXYLATE|ethyl 4-methyl-2-[[2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetyl]amino]-1,3-thiazole-5-carboxylate|ethyl 4-methyl-2-{[(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetyl]amino}-1,3-thiazole-5-carboxylate
| Molecular Formula | C18H16N6O3S2 |
|---|---|
| Molecular Weight | 428.07254 g/mol |
| LogP | 3.17852 |
| Topological Polar Surface Area | 122.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 428.07254 |
| Monoisotopic Mass | 428.07254 |
| Heavy Atoms | 29 |
| Complexity | 1218.9833 |
Chemical Identifiers
| CAS Number | 433261-36-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC3=C(C4=CC=CC=C4N3)N=N2)C |
Product Overview
AC1NWRU1 (CAS 433261-36-0), with molecular formula C18H16N6O3S2 and molecular weight 428.07254 g/mol. IUPAC: ethyl 4-methyl-2-[[2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetyl]amino]-1,3-thiazole-5-carboxylate.
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