Vitas-M small molecule compound

3-benzyl-6-{5-methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazol-4-yl}[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STL022701
SMILES Cc1c(nnn1c1cccc(c1)C(F)(F)F)c1nn2c(s1)nnc2Cc1ccccc1

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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 C20H14F3N7S MW 441.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14F3N7S/c1-12-17(25-28-29(12)15-9-5-8-14(11-15)20(21,22)23)18-27-30-16(24-26-19(30)31-18)10-13-6-3-2-4-7-13/h2-9,11H,10H2,1H3
InChIKey
YYQFJXHNKDMSNS-UHFFFAOYSA-N
Synonyms
890602-82-1
3benzyl6(5methyl1(3(trifluoromethyl)phenyl)1H123triazol4yl)(124)triazolo(34b)(134)thiadiazole
3benzyl6(5methyl1(3(trifluoromethyl)phenyl)triazol4yl)(124)triazolo(34b)(134)thiadiazole
6(5METHYL1(3(TRIFLUOROMETHYL)PHENYL)(123TRIAZOL4YL))3BENZYL124TRIAZOLO(34B)134THIADIAZOLINE
890602821
CC1=C(N=NN1C2=CC=CC(=C2)C(F)(F)F)C3=NN4C(=NN=C4S3)CC5=CC=CC=C5
InChI=1SC20H14F3N7Sc11217(252829(12)1595814(1115)20(2122)23)18273016(242619(30)3118)10136324713h2911H10H21H3
MFCD07802225
ZINC000008818953
ZINC08818953
ZINC8818953

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Available files

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