Vitas-M small molecule compound
N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-5-[2-(5-methyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Catalog ID
STL398434
SMILES Fc1cccc(c1Cn1ccc(n1)Nc1nnc(s1)CCn1ncc(c1C)[N+](=O)[O-])Cl
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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/c1-11-15(28(29)30)9-21-27(11)8-6-17-23-24-18(31-17)22-16-5-7-26(25-16)10-12-13(19)3-2-4-14(12)20/h2-5,7,9H,6,8,10H2,1H3,(H,22,24,25)InChIKey
FMIOIXYBSIMOMQ-UHFFFAOYSA-NSynonyms
1005667-55-91005667559
CC1=C(C=NN1CCC2=NN=C(S2)NC3=NN(C=C3)CC4=C(C=CC=C4Cl)F)(N+)(=O)(O)
Fc1cccc(c1Cn1ccc(n1)Nc1nnc(s1)CCn1ncc(c1C)(N+)(=O)(O))Cl
InChI=1SC18H16ClFN8O2Sc11115(28(29)30)92127(11)8617232418(3117)22165726(2516)101213(19)32414(12)20h2579H6810H21H3(H222425)
MFCD04140384
N(1((2chloro6fluorophenyl)methyl)pyrazol3yl)5(2(5methyl4nitropyrazol1yl)ethyl)134thiadiazol2amine
N(1(2CHLORO6FLUOROBENZYL)1HPYRAZOL3YL)5(2(5METHYL4NITRO1HPYRAZOL1YL)ETHYL)134THIADIAZOL2AMINE
ZINC000002731193
ZINC02731193
ZINC2731193
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