Vitas-M small molecule compound
N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-5-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-1,3,4-thiadiazol-2-amine
Catalog ID
STL395416
SMILES Cc1cc(nn1Cc1nnc(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 C17H14ClFN8O2S MW 448.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClFN8O2S/c1-10-7-15(27(28)29)24-26(10)9-16-21-22-17(30-16)20-14-5-6-25(23-14)8-11-12(18)3-2-4-13(11)19/h2-7H,8-9H2,1H3,(H,20,22,23)InChIKey
LHRPLDBYSLZDFB-UHFFFAOYSA-NSynonyms
1005576-27-11005576271
CC1=CC(=NN1CC2=NN=C(S2)NC3=NN(C=C3)CC4=C(C=CC=C4Cl)F)(N+)(=O)(O)
Cc1cc(nn1Cc1nnc(s1)Nc1ccn(n1)Cc1c(F)cccc1Cl)(N+)(=O)(O)
InChI=1SC17H14ClFN8O2Sc110715(27(28)29)2426(10)916212217(3016)20145625(2314)81112(18)32413(11)19h27H89H21H3(H202223)
MFCD04140662
N(1((2chloro6fluorophenyl)methyl)pyrazol3yl)5((5methyl3nitropyrazol1yl)methyl)134thiadiazol2amine
N(1(2CHLORO6FLUOROBENZYL)1HPYRAZOL3YL)5((5METHYL3NITRO1HPYRAZOL1YL)METHYL)134THIADIAZOL2AMINE
ZINC000002731490
ZINC02731490
ZINC2731490
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