AC1NKPUG
N-(4-butan-2-ylphenyl)-2-[[5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: 2-{4-(4-methylphenyl)-5-[(4-methylphenoxy)methyl](1,2,4-triazol-3-ylthio)}-N-[ 4-(methylpropyl)phenyl]acetamide|N-(4-(sec-butyl)phenyl)-2-((4-(p-tolyl)-5-((p-tolyloxy)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(4-butan-2-ylphenyl)-2-[[5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-[4-(butan-2-yl)phenyl]-2-({5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide|N-[4-(butan-2-yl)phenyl]-2-{[5-(4-methylphenoxymethyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C29H32N4O2S |
|---|---|
| Molecular Weight | 500.2246 g/mol |
| LogP | 6.70744 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 500.2246 |
| Monoisotopic Mass | 500.2246 |
| Heavy Atoms | 36 |
| Complexity | 1282.6161 |
Chemical Identifiers
| CAS Number | 899403-29-3 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)C)COC4=CC=C(C=C4)C |
Product Overview
AC1NKPUG (CAS 899403-29-3), with molecular formula C29H32N4O2S and molecular weight 500.2246 g/mol. IUPAC: N-(4-butan-2-ylphenyl)-2-[[5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.