AC1LE02L
4-methyl-3-[(2-methylphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole
Also Known As: KS-00003OFT|MS-2028|4-methyl-3-{[(2-methylphenyl)methyl]sulfanyl}-5-(thiophen-2-yl)-4H-1,2,4-triazole|4-Methyl-3-((2-methylbenzyl)thio)-5-(thiophen-2-yl)-4H-1,2,4-triazole|4-methyl-3-[(2-methylphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole|4-methyl-3-(o-tolylmethylsulfanyl)-5-(2-thienyl)-1,2,4-triazole|4-methyl-3-[(2-methylbenzyl)sulfanyl]-5-(2-thienyl)-4H-1,2,4-triazole|4-methyl-3-[(2-methylbenzyl)sulfanyl]-5-(thiophen-2-yl)-4H-1,2,4-triazole
| Molecular Formula | C15H15N3S2 |
|---|---|
| Molecular Weight | 301.07074 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 84.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.07074 |
| Monoisotopic Mass | 301.07074 |
| Heavy Atoms | 20 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 294848-72-9 |
|---|---|
| SMILES | CC1=CC=CC=C1CSC2=NN=C(N2C)C3=CC=CS3 |
| InChIKey | VJTNNIOWMBZUGK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
AC1LE02L (CAS 294848-72-9), with molecular formula C15H15N3S2 and molecular weight 301.07074 g/mol. IUPAC: 4-methyl-3-[(2-methylphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole.
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