Vitas-M small molecule compound
N-[1-(2-chlorobenzyl)-1H-pyrazol-3-yl]-5-[1-(5-methyl-3-nitro-1H-pyrazol-1-yl)propan-2-yl]-1,3,4-thiadiazol-2-amine
Catalog ID
STL394822
SMILES CC(c1nnc(s1)Nc1ccn(n1)Cc1ccccc1Cl)Cn1nc(cc1C)[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 C19H19ClN8O2S MW 458.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN8O2S/c1-12(10-27-13(2)9-17(25-27)28(29)30)18-22-23-19(31-18)21-16-7-8-26(24-16)11-14-5-3-4-6-15(14)20/h3-9,12H,10-11H2,1-2H3,(H,21,23,24)InChIKey
BFGIFBSYLZTFQF-UHFFFAOYSA-NSynonyms
1005614-52-71005614527
CC(c1nnc(s1)Nc1ccn(n1)Cc1ccccc1Cl)Cn1nc(cc1C)(N+)(=O)(O)
CC1=CC(=NN1CC(C)C2=NN=C(S2)NC3=NN(C=C3)CC4=CC=CC=C4Cl)(N+)(=O)(O)
InChI=1SC19H19ClN8O2Sc112(102713(2)917(2527)28(29)30)18222319(3118)21167826(2416)1114534615(14)20h3912H1011H212H3(H212324)
MFCD04141264
N(1((2chlorophenyl)methyl)pyrazol3yl)5(1(5methyl3nitropyrazol1yl)propan2yl)134thiadiazol2amine
N(1(2CHLOROBENZYL)1HPYRAZOL3YL)5(1(5METHYL3NITRO1HPYRAZOL1YL)PROPAN2YL)134THIADIAZOL2AMINE
ZINC000002732685
ZINC000002732686
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