Vitas-M small molecule compound
6-(1,3-benzodioxol-5-yl)-3-(3,4-dimethoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Catalog ID
STL364060
SMILES COc1ccc(cc1OC)c1nnc2n1N=C(CS2)c1ccc2c(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 C19H16N4O4S MW 396.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4O4S/c1-24-14-5-4-12(8-16(14)25-2)18-20-21-19-23(18)22-13(9-28-19)11-3-6-15-17(7-11)27-10-26-15/h3-8H,9-10H2,1-2H3InChIKey
PQEXBBDXOQIJGE-UHFFFAOYSA-NSynonyms
840516-17-84(6(2HBENZO(34D)13DIOXOLEN5YL)(7H124TRIAZOLO(34B)134THIADIAZIN3YL))12DIMETHOXYBENZENE
6(13benzodioxol5yl)3(34dimethoxyphenyl)7H(124)triazolo(34b)(134)thiadiazine
6(2H13BENZODIOXOL5YL)3(34DIMETHOXYPHENYL)7H(124)TRIAZOLO(34B)(134)THIADIAZINE
6(benzo(d)(13)dioxol5yl)3(34dimethoxyphenyl)7H(124)triazolo(34b)(134)thiadiazine
840516178
COC1=C(C=C(C=C1)C2=NN=C3N2N=C(CS3)C4=CC5=C(C=C4)OCO5)OC
InChI=1SC19H16N4O4Sc124145412(816(14)252)1820211923(18)2213(92819)11361517(711)27102615h38H910H212H3
MFCD04010477
ZINC000005025230
ZINC05025230
ZINC5025230
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