2-((4-Allyl-5-((phenylthio)ME)-4H-1,2,4-triazol-3-YL)thio)-1-(4-BR-PH)ethanone
1-(4-bromophenyl)-2-[[5-(phenylsulfanylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
Also Known As: 2-((4-Allyl-5-((phenylthio)methyl)-4H-1,2,4-triazol-3-yl)thio)-1-(4-bromophenyl)ethanone|2-((4-ALLYL-5-((PHENYLTHIO)ME)-4H-1,2,4-TRIAZOL-3-YL)THIO)-1-(4-BR-PH)ETHANONE|1-(4-bromophenyl)-2-[[5-(phenylsulfanylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanone|1-(4-BROMOPHENYL)-2-({5-[(PHENYLSULFANYL)METHYL]-4-(PROP-2-EN-1-YL)-4H-1,2,4-TRIAZOL-3-YL}SULFANYL)ETHAN-1-ONE|1-(4-bromophenyl)-2-[5-(phenylthiomethyl)-4-prop-2-enyl(1,2,4-triazol-3-ylthio )]ethan-1-one|644-843-8
| Molecular Formula | C20H18BrN3OS2 |
|---|---|
| Molecular Weight | 459.00748 g/mol |
| LogP | 5.4939 |
| Topological Polar Surface Area | 47.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 459.00748 |
| Monoisotopic Mass | 459.00748 |
| Heavy Atoms | 27 |
| Complexity | 910.7361 |
Chemical Identifiers
| CAS Number | 538337-47-2 |
|---|---|
| SMILES | C=CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Br)CSC3=CC=CC=C3 |
Product Overview
2-((4-Allyl-5-((phenylthio)ME)-4H-1,2,4-triazol-3-YL)thio)-1-(4-BR-PH)ethanone (CAS 538337-47-2), with molecular formula C20H18BrN3OS2 and molecular weight 459.00748 g/mol. IUPAC: 1-(4-bromophenyl)-2-[[5-(phenylsulfanylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanone.
2-((4-Allyl-5-((phenylthio)ME)-4H-1,2,4-triazol-3-YL)thio)-1-(4-BR-PH)ethanone is a custom synthesis product. We offer services from milligram to kilogram scale.
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