Vitas-M small molecule compound

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

Catalog ID
STK913734
SMILES COc1ccc(cc1)Cc1nn2c(s1)nnc2c1[nH]nc(c1)C(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)13-9-14(19-18-13)16-20-21-17-23(16)22-15(25-17)8-11-4-6-12(24-3)7-5-11/h4-7,9-10H,8H2,1-3H3,(H,18,19)
InChIKey
ODDMZGLLVFPUEK-UHFFFAOYSA-N
Synonyms
1441880-78-9
1441880789
3(3isopropyl1Hpyrazol5yl)6(4methoxybenzyl)(124)triazolo(34b)(134)thiadiazole
6((4methoxyphenyl)methyl)3(5propan2yl1Hpyrazol3yl)(124)triazolo(34b)(134)thiadiazole
6(4methoxybenzyl)3(3(propan2yl)1Hpyrazol5yl)(124)triazolo(34b)(134)thiadiazole
CC(C)C1=CC(=NN1)C2=NN=C3N2N=C(S3)CC4=CC=C(C=C4)OC
COc1ccc(cc1)Cc1nn2c(s1)nnc2c1(nH)nc(c1)C(C)C
InChI=1SC17H18N6OSc110(2)13914(191813)1620211723(16)2215(2517)8114612(243)7511h47910H8H213H3(H1819)
MFCD13956234
ZINC000022502391
ZINC22502391

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Available files

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