Vitas-M small molecule compound

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

Catalog ID
STK644454
SMILES COc1ccccc1c1nn2c(s1)nnc2c1n[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)15-20-21-17-23(15)22-16(25-17)12-6-4-5-7-14(12)24-3/h4-7,9-10H,8H2,1-3H3,(H,18,19)
InChIKey
LDBKARHDWVCEQJ-UHFFFAOYSA-N
Synonyms
1187331-89-0
1187331890
3(3isobutyl1Hpyrazol5yl)6(2methoxyphenyl)(124)triazolo(34b)(134)thiadiazole
6(2methoxyphenyl)3(5(2methylpropyl)1Hpyrazol3yl)(124)triazolo(34b)(134)thiadiazole
CC(C)CC1=CC(=NN1)C2=NN=C3N2N=C(S3)C4=CC=CC=C4OC
COc1ccccc1c1nn2c(s1)nnc2c1(nH)nc(c1)CC(C)C
COc1ccccc1c1nn2c(s1)nnc2c1n(nH)c(c1)CC(C)C
InChI=1SC17H18N6OSc110(2)811913(191811)1520211723(15)2216(2517)12645714(12)243h47910H8H213H3(H1819)
MFCD18163620
ZINC000012323806
ZINC12323806

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Available files

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