Vitas-M small molecule compound
3-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-4-methyl-5-phenyl-4H-1,2,4-triazole
Catalog ID
STK734361
SMILES Cn1c(SCc2ccc3c(c2)OCO3)nnc1c1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H15N3O2S MW 325.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O2S/c1-20-16(13-5-3-2-4-6-13)18-19-17(20)23-10-12-7-8-14-15(9-12)22-11-21-14/h2-9H,10-11H2,1H3InChIKey
GNRDOSDAWZCYSK-UHFFFAOYSA-NSynonyms
3((13BENZODIOXOL5YLMETHYL)SULFANYL)4METHYL5PHENYL4H124TRIAZOLE
3((13BENZODIOXOL5YLMETHYL)THIO)4METHYL5PHENYL4H124TRIAZOLE
3(13BENZODIOXOL5YLMETHYLSULFANYL)4METHYL5PHENYL124TRIAZOLE
3(2HBENZO(34D)13DIOXOLEN5YLMETHYLTHIO)4METHYL5PHENYL124TRIAZOLE
CN1C(=NN=C1SCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4
InChI=1SC17H15N3O2Sc12016(135324613)181917(20)231012781415(912)22112114h29H1011H21H3
MFCD01418241
ZINC000000060966
ZINC00060966
ZINC60966
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