AC1LYRPP
1-[3-ethoxy-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-4-yl]-N-(3-methylphenyl)spiro[4H-naphthalene-3,1'-cyclohexane]-2-carboxamide
Also Known As: 1-[3-ethoxy-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-4-yl]-N-(3-methylphenyl)spiro[4H-naphthalene-3,1'-cyclohexane]-2-carboxamide|4'-(3-ethoxy-5-((2-methylallyl)thio)-4H-1,2,4-triazol-4-yl)-N-(m-tolyl)-1'H-spiro[cyclohexane-1,2'-naphthalene]-3'-carboxamide|4'-{3-ethoxy-5-[(2-methylprop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-4-yl}-N-(3-methylphenyl)-1'H-spiro[cyclohexane-1,2'-naphthalene]-3'-carboxamide
| Molecular Formula | C31H36N4O2S |
|---|---|
| Molecular Weight | 528.2559 g/mol |
| LogP | 7.05812 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 528.2559 |
| Monoisotopic Mass | 528.2559 |
| Heavy Atoms | 38 |
| Complexity | 1384.0212 |
Chemical Identifiers
| CAS Number | 374089-98-2 |
|---|---|
| SMILES | CCOC1=NN=C(N1C2=C(C3(CCCCC3)CC4=CC=CC=C42)C(=O)NC5=CC=CC(=C5)C)SCC(=C)C |
Product Overview
AC1LYRPP (CAS 374089-98-2), with molecular formula C31H36N4O2S and molecular weight 528.2559 g/mol. IUPAC: 1-[3-ethoxy-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-4-yl]-N-(3-methylphenyl)spiro[4H-naphthalene-3,1'-cyclohexane]-2-carboxamide.
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