Vitas-M small molecule compound
N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-5-[1-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Catalog ID
STL396441
SMILES Cc1cc(nn1C(c1nnc(s1)Nc1ccn(n1)Cc1c(F)cccc1Cl)C)[N+](=O)[O-]
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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 C18H16ClFN8O2S MW 462.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClFN8O2S/c1-10-8-16(28(29)30)25-27(10)11(2)17-22-23-18(31-17)21-15-6-7-26(24-15)9-12-13(19)4-3-5-14(12)20/h3-8,11H,9H2,1-2H3,(H,21,23,24)InChIKey
KQEQTBUJOYOSOJ-UHFFFAOYSA-NSynonyms
1005623-28-81005623288
CC1=CC(=NN1C(C)C2=NN=C(S2)NC3=NN(C=C3)CC4=C(C=CC=C4Cl)F)(N+)(=O)(O)
Cc1cc(nn1C(c1nnc(s1)Nc1ccn(n1)Cc1c(F)cccc1Cl)C)(N+)(=O)(O)
InChI=1SC18H16ClFN8O2Sc110816(28(29)30)2527(10)11(2)17222318(3117)21156726(2415)91213(19)43514(12)20h3811H9H212H3(H212324)
MFCD04139982
N(1((2chloro6fluorophenyl)methyl)pyrazol3yl)5(1(5methyl3nitropyrazol1yl)ethyl)134thiadiazol2amine
N(1(2CHLORO6FLUOROBENZYL)1HPYRAZOL3YL)5(1(5METHYL3NITRO1HPYRAZOL1YL)ETHYL)134THIADIAZOL2AMINE
ZINC000002730760
ZINC000002730761
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