Vitas-M small molecule compound

3-[(4-methoxyphenoxy)methyl]-6-[5-(2-methylpropyl)-1H-pyrazol-3-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STK624099
SMILES COc1ccc(cc1)OCc1nnc2n1nc(s2)c1n[nH]c(c1)CC(C)C

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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 C18H20N6O2S MW 384.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6O2S/c1-11(2)8-12-9-15(20-19-12)17-23-24-16(21-22-18(24)27-17)10-26-14-6-4-13(25-3)5-7-14/h4-7,9,11H,8,10H2,1-3H3,(H,19,20)
InChIKey
QDWRMGKXSHVUHS-UHFFFAOYSA-N
Synonyms
1047983-10-7
1047983107
3((4methoxyphenoxy)methyl)6(5(2methylpropyl)1Hpyrazol3yl)(124)triazolo(34b)(134)thiadiazole
6(3isobutyl1Hpyrazol5yl)3((4methoxyphenoxy)methyl)(124)triazolo(34b)(134)thiadiazole
CC(C)CC1=CC(=NN1)C2=NN3C(=NN=C3S2)COC4=CC=C(C=C4)OC
COc1ccc(cc1)OCc1nnc2n1nc(s2)c1(nH)nc(c1)CC(C)C
COc1ccc(cc1)OCc1nnc2n1nc(s2)c1n(nH)c(c1)CC(C)C
InChI=1SC18H20N6O2Sc111(2)812915(201912)17232416(212218(24)2717)1026146413(253)5714h47911H810H213H3(H1920)
MFCD09792619
ZINC000013570563
ZINC13570563

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Available files

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