Vitas-M small molecule compound

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

Catalog ID
STK640853
SMILES COc1cccc(c1)c1nn2c(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)7-12-9-14(19-18-12)15-20-21-17-23(15)22-16(25-17)11-5-4-6-13(8-11)24-3/h4-6,8-10H,7H2,1-3H3,(H,18,19)
InChIKey
DTQZEOZZAGMLTG-UHFFFAOYSA-N
Synonyms
1049801-53-7
1049801537
3(3isobutyl1Hpyrazol5yl)6(3methoxyphenyl)(124)triazolo(34b)(134)thiadiazole
6(3methoxyphenyl)3(5(2methylpropyl)1Hpyrazol3yl)(124)triazolo(34b)(134)thiadiazole
CC(C)CC1=CC(=NN1)C2=NN=C3N2N=C(S3)C4=CC(=CC=C4)OC
COc1cccc(c1)c1nn2c(s1)nnc2c1(nH)nc(c1)CC(C)C
COc1cccc(c1)c1nn2c(s1)nnc2c1n(nH)c(c1)CC(C)C
InChI=1SC17H18N6OSc110(2)712914(191812)1520211723(15)2216(2517)1154613(811)243h46810H7H213H3(H1819)
MFCD18162472
ZINC000013735261
ZINC13735261

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Available files

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