Vitas-M small molecule compound

N-(1-benzyl-1H-pyrazol-3-yl)-5-[4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-1,3,4-thiadiazol-2-amine

Catalog ID
STK311875
SMILES Cn1nc(c(c1c1nnc(s1)Nc1ccn(n1)Cc1ccccc1)Br)C(F)(F)F

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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 C17H13BrF3N7S MW 484.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13BrF3N7S/c1-27-13(12(18)14(26-27)17(19,20)21)15-23-24-16(29-15)22-11-7-8-28(25-11)9-10-5-3-2-4-6-10/h2-8H,9H2,1H3,(H,22,24,25)
InChIKey
NCWHSLIKLNJPAA-UHFFFAOYSA-N
Synonyms
1005626-93-6
1005626936
CN1C(=C(C(=N1)C(F)(F)F)Br)C2=NN=C(S2)NC3=NN(C=C3)CC4=CC=CC=C4
InChI=1SC17H13BrF3N7Sc12713(12(18)14(2627)17(1920)21)15232416(2915)22117828(2511)9105324610h28H9H21H3(H222425)
MFCD04140258
N(1benzyl1Hpyrazol3yl)5(4bromo1methyl3(trifluoromethyl)1Hpyrazol5yl)134thiadiazol2amine
N(1benzylpyrazol3yl)5(4bromo2methyl5(trifluoromethyl)pyrazol3yl)134thiadiazol2amine
ZINC000002731058
ZINC02731058
ZINC2731058

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Available files

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