Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-6-[(E)-2-(4-methoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK621094
SMILES COc1ccc(cc1)/C=C/c1nn2c(s1)nnc2c1ccc2c(c1)OCO2
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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 C19H14N4O3S MW 378.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14N4O3S/c1-24-14-6-2-12(3-7-14)4-9-17-22-23-18(20-21-19(23)27-17)13-5-8-15-16(10-13)26-11-25-15/h2-10H,11H2,1H3/b9-4+InChIKey
AHSYPVRQIJZZJX-RUDMXATFSA-NSynonyms
951956-54-0(E)3(benzo(d)(13)dioxol5yl)6(4methoxystyryl)(124)triazolo(34b)(134)thiadiazole
3(13benzodioxol5yl)6((E)2(4methoxyphenyl)ethenyl)(124)triazolo(34b)(134)thiadiazole
951956540
COC1=CC=C(C=C1)C=CC2=NN3C(=NN=C3S2)C4=CC5=C(C=C4)OCO5
COc1ccc(cc1)C=Cc1nn2c(s1)nnc2c1ccc2c(c1)OCO2
InChI=1SC19H14N4O3Sc124146212(3714)4917222318(202119(23)2717)13581516(1013)26112515h210H11H21H3b94+
MFCD09855241
ZINC000013721772
ZINC13721772
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