Vitas-M small molecule compound
N-(1-benzyl-1H-pyrazol-3-yl)-5-[1-(5-methyl-3-nitro-1H-pyrazol-1-yl)propyl]-1,3,4-thiadiazol-2-amine
Catalog ID
STL395578
SMILES CCC(n1nc(cc1C)[N+](=O)[O-])c1nnc(s1)Nc1ccn(n1)Cc1ccccc1
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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 C19H20N8O2S MW 424.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N8O2S/c1-3-15(26-13(2)11-17(24-26)27(28)29)18-21-22-19(30-18)20-16-9-10-25(23-16)12-14-7-5-4-6-8-14/h4-11,15H,3,12H2,1-2H3,(H,20,22,23)InChIKey
QAOBZAKQACNWFM-UHFFFAOYSA-NSynonyms
1005614-10-71005614107
CCC(C1=NN=C(S1)NC2=NN(C=C2)CC3=CC=CC=C3)N4C(=CC(=N4)(N+)(=O)(O))C
CCC(n1nc(cc1C)(N+)(=O)(O))c1nnc(s1)Nc1ccn(n1)Cc1ccccc1
InChI=1SC19H20N8O2Sc1315(2613(2)1117(2426)27(28)29)18212219(3018)201691025(2316)12147546814h41115H312H212H3(H202223)
MFCD04140908
N(1BENZYL1HPYRAZOL3YL)5(1(5METHYL3NITRO1HPYRAZOL1YL)PROPYL)134THIADIAZOL2AMINE
N(1benzylpyrazol3yl)5(1(5methyl3nitropyrazol1yl)propyl)134thiadiazol2amine
ZINC000002732283
ZINC000002732284
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