Vitas-M small molecule compound
N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-5-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Catalog ID
STL396591
SMILES Cc1cc(nn1CCc1nnc(s1)Nc1ccn(n1)Cc1c(F)cccc1Cl)[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/c1-11-9-16(28(29)30)25-27(11)8-6-17-22-23-18(31-17)21-15-5-7-26(24-15)10-12-13(19)3-2-4-14(12)20/h2-5,7,9H,6,8,10H2,1H3,(H,21,23,24)InChIKey
FXUNEORPNJGDOF-UHFFFAOYSA-NSynonyms
1005662-22-51005662225
CC1=CC(=NN1CCC2=NN=C(S2)NC3=NN(C=C3)CC4=C(C=CC=C4Cl)F)(N+)(=O)(O)
Cc1cc(nn1CCc1nnc(s1)Nc1ccn(n1)Cc1c(F)cccc1Cl)(N+)(=O)(O)
InChI=1SC18H16ClFN8O2Sc111916(28(29)30)2527(11)8617222318(3117)21155726(2415)101213(19)32414(12)20h2579H6810H21H3(H212324)
MFCD04140044
N(1((2chloro6fluorophenyl)methyl)pyrazol3yl)5(2(5methyl3nitropyrazol1yl)ethyl)134thiadiazol2amine
N(1(2CHLORO6FLUOROBENZYL)1HPYRAZOL3YL)5(2(5METHYL3NITRO1HPYRAZOL1YL)ETHYL)134THIADIAZOL2AMINE
ZINC000002730818
ZINC02730818
ZINC2730818
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