Vitas-M small molecule compound
6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK708241
SMILES COc1ccc(cc1OC)c1nnc2n1nc(s2)Cc1ccc2c(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 C20H18N4O4S MW 410.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O4S/c1-25-14-6-4-13(11-16(14)26-2)19-21-22-20-24(19)23-18(29-20)10-12-3-5-15-17(9-12)28-8-7-27-15/h3-6,9,11H,7-8,10H2,1-2H3InChIKey
NQEOWGNOSLVZJS-UHFFFAOYSA-NSynonyms
902012-39-96((23dihydrobenzo(b)(14)dioxin6yl)methyl)3(34dimethoxyphenyl)(124)triazolo(34b)(134)thiadiazole
6(23dihydro14benzodioxin6ylmethyl)3(34dimethoxyphenyl)(124)triazolo(34b)(134)thiadiazole
902012399
COC1=C(C=C(C=C1)C2=NN=C3N2N=C(S3)CC4=CC5=C(C=C4)OCCO5)OC
InChI=1SC20H18N4O4Sc125146413(1116(14)262)1921222024(19)2318(2920)1012351517(912)28872715h36911H7810H212H3
MFCD06785179
ZINC000009420439
ZINC09420439
ZINC9420439
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