AC1M0E4M
2-[[4-amino-5-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-butylphenyl)acetamide
Also Known As: 2-{[4-amino-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-butylphenyl)acetamide|2-((4-amino-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-butylphenyl)acetamide|2-[[4-amino-5-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-butylphenyl)acetamide|2-[4-amino-5-(3-methoxyphenyl)(1,2,4-triazol-3-ylthio)]-N-(4-butylphenyl)aceta mide
| Molecular Formula | C21H25N5O2S |
|---|---|
| Molecular Weight | 411.17288 g/mol |
| LogP | 3.7409 |
| Topological Polar Surface Area | 95.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 411.17288 |
| Monoisotopic Mass | 411.17288 |
| Heavy Atoms | 29 |
| Complexity | 955.96027 |
Chemical Identifiers
| CAS Number | 586997-41-3 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2N)C3=CC(=CC=C3)OC |
Product Overview
AC1M0E4M (CAS 586997-41-3), with molecular formula C21H25N5O2S and molecular weight 411.17288 g/mol. IUPAC: 2-[[4-amino-5-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-butylphenyl)acetamide.
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