AC1NY7TX
2-[[5-(2-hydroxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 07787674|2-{[5-(2-hydroxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|SR-01000324273-1|2-((4-Allyl-5-(2-hydroxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetamide|2-[4-Allyl-5-(2-hydroxy-phenyl)-4H-[1,2,4]triazol-3-ylsulfanyl]-acetamide|2-[[4-allyl-5-(2-hydroxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide|2-[[5-(2-hydroxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide|2-[[(5Z)-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-prop-2-enyl-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide|2-[[5-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-prop-2-enyl-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C13H14N4O2S |
|---|---|
| Molecular Weight | 290.08374 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 290.08374 |
| Monoisotopic Mass | 290.08374 |
| Heavy Atoms | 20 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 797768-74-2 |
|---|---|
| SMILES | C=CCN1C(=NN=C1SCC(=O)N)C2=CC=CC=C2O |
| InChIKey | OXAKTBQDGMYXDC-UHFFFAOYSA-N |
Product Overview
AC1NY7TX (CAS 797768-74-2), with molecular formula C13H14N4O2S and molecular weight 290.08374 g/mol. IUPAC: 2-[[5-(2-hydroxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
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