Vitas-M small molecule compound
N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-5-[2-(4-nitro-1H-pyrazol-1-yl)propan-2-yl]-1,3,4-thiadiazol-2-amine
Catalog ID
STL392484
SMILES Fc1cccc(c1Cn1ccc(n1)Nc1nnc(s1)C(n1ncc(c1)[N+](=O)[O-])(C)C)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/c1-18(2,27-9-11(8-21-27)28(29)30)16-23-24-17(31-16)22-15-6-7-26(25-15)10-12-13(19)4-3-5-14(12)20/h3-9H,10H2,1-2H3,(H,22,24,25)InChIKey
KFHZOZXUVKJQTI-UHFFFAOYSA-NSynonyms
1005623-60-81005623608
CC(C)(C1=NN=C(S1)NC2=NN(C=C2)CC3=C(C=CC=C3Cl)F)N4C=C(C=N4)(N+)(=O)(O)
Fc1cccc(c1Cn1ccc(n1)Nc1nnc(s1)C(n1ncc(c1)(N+)(=O)(O))(C)C)Cl
InChI=1SC18H16ClFN8O2Sc118(227911(82127)28(29)30)16232417(3116)22156726(2515)101213(19)43514(12)20h39H10H212H3(H222425)
MFCD04140104
N(1((2chloro6fluorophenyl)methyl)pyrazol3yl)5(2(4nitropyrazol1yl)propan2yl)134thiadiazol2amine
N(1(2chloro6fluorobenzyl)1Hpyrazol3yl)5(2(4nitro1Hpyrazol1yl)propan2yl)134thiadiazol2amine
ZINC000002730885
ZINC02730885
ZINC2730885
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