Vitas-M small molecule compound

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

Catalog ID
STK639777
SMILES COc1ccccc1c1nnc2n1nc(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 C17H18N6OS MW 354.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N6OS/c1-10(2)8-11-9-13(19-18-11)16-22-23-15(20-21-17(23)25-16)12-6-4-5-7-14(12)24-3/h4-7,9-10H,8H2,1-3H3,(H,18,19)
InChIKey
CNWFCJRXYOJDTR-UHFFFAOYSA-N
Synonyms
1107059-86-8
3(2methoxyphenyl)6(5(2methylpropyl)1Hpyrazol3yl)(124)triazolo(34b)(134)thiadiazole
6(3isobutyl1Hpyrazol5yl)3(2methoxyphenyl)(124)triazolo(34b)(134)thiadiazole
CC(C)CC1=CC(=NN1)C2=NN3C(=NN=C3S2)C4=CC=CC=C4OC
COc1ccccc1c1nnc2n1nc(s2)c1(nH)nc(c1)CC(C)C
COc1ccccc1c1nnc2n1nc(s2)c1n(nH)c(c1)CC(C)C
Registry IDs
MFCD18162117
ZINC000012324058
ZINC12324058

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Available files

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