Vitas-M small molecule compound
3-[(2,4-dichlorophenoxy)methyl]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Catalog ID
STK679574
SMILES Clc1ccc(c(c1)Cl)OCc1nnc2n1N=C(CS2)c1ccc2c(c1)OCCO2
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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 C19H14Cl2N4O3S MW 449.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14Cl2N4O3S/c20-12-2-4-15(13(21)8-12)28-9-18-22-23-19-25(18)24-14(10-29-19)11-1-3-16-17(7-11)27-6-5-26-16/h1-4,7-8H,5-6,9-10H2InChIKey
LYHMHXBHSOQERN-UHFFFAOYSA-NSynonyms
1((6(2H3HBENZO(34E)14DIOXIN6YL)(7H124TRIAZOLO(34B)134THIADIAZIN3YL))METHOXY)24DICHLOROBENZENE
3((24dichlorophenoxy)methyl)6(23dihydro14benzodioxin6yl)7H(124)triazolo(34b)(134)thiadiazine
C1COC2=C(O1)C=CC(=C2)C3=NN4C(=NN=C4SC3)COC5=C(C=C(C=C5)Cl)Cl
InChI=1SC19H14Cl2N4O3Sc20122415(13(21)812)2891822231925(18)2414(102919)11131617(711)27652616h1478H56910H2
MFCD03459458
ZINC000004100092
ZINC04100092
ZINC4100092
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