Vitas-M small molecule compound

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

Catalog ID
STL031999
SMILES Clc1ccc(cc1)OCc1nn2c(s1)nnc2c1[nH]nc(c1)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 C14H11ClN6OS MW 346.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11ClN6OS/c1-8-6-11(17-16-8)13-18-19-14-21(13)20-12(23-14)7-22-10-4-2-9(15)3-5-10/h2-6H,7H2,1H3,(H,16,17)
InChIKey
YKVGKHCFAAENPV-UHFFFAOYSA-N
Synonyms
850824-96-3
4CHLORO1((3(3METHYLPYRAZOL5YL)(124TRIAZOLO(34B)134THIADIAZOLIN6YL))METHOXY)BENZENE
5(6(4CHLOROPHENOXYMETHYL)(124)TRIAZOLO(34B)(134)THIADIAZOL3YL)3METHYL1HPYRAZOLE
6((4chlorophenoxy)methyl)3(3methyl1Hpyrazol5yl)(124)triazolo(34b)(134)thiadiazole
6((4CHLOROPHENOXY)METHYL)3(5METHYL1HPYRAZOL3YL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
850824963
CC1=CC(=NN1)C2=NN=C3N2N=C(S3)COC4=CC=C(C=C4)Cl
Clc1ccc(cc1)OCc1nn2c(s1)nnc2c1(nH)nc(c1)C
InChI=1SC14H11ClN6OSc18611(17168)1318191421(13)2012(2314)72210429(15)3510h26H7H21H3(H1617)
MFCD05694104
ZINC000005457241
ZINC05457241
ZINC5457241

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Available files

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