Vitas-M small molecule compound
3-(5-{[(6-bromo-1,3-benzodioxol-5-yl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)pyridine
Catalog ID
STK869165
SMILES Brc1cc2OCOc2cc1CSc1nnc(n1C)c1cccnc1
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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 C16H13BrN4O2S MW 405.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrN4O2S/c1-21-15(10-3-2-4-18-7-10)19-20-16(21)24-8-11-5-13-14(6-12(11)17)23-9-22-13/h2-7H,8-9H2,1H3InChIKey
HMCMVTRXWQUHFS-UHFFFAOYSA-NSynonyms
878416-83-23(5(((6bromo13benzodioxol5yl)methyl)sulfanyl)4methyl4H124triazol3yl)pyridine
3(5(((6bromobenzo(d)(13)dioxol5yl)methyl)thio)4methyl4H124triazol3yl)pyridine
3(5((6BROMO13BENZODIOXOL5YL)METHYLSULFANYL)4METHYL124TRIAZOL3YL)PYRIDINE
878416832
CN1C(=NN=C1SCC2=CC3=C(C=C2Br)OCO3)C4=CN=CC=C4
InChI=1SC16H13BrN4O2Sc12115(1032418710)192016(21)2481151314(612(11)17)2392213h27H89H21H3
MFCD07396915
ZINC000004511914
ZINC04511914
ZINC4511914
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