Vitas-M small molecule compound
N-(1-benzyl-1H-pyrazol-3-yl)-5-[1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Catalog ID
STK311683
SMILES [O-][N+](=O)c1c(C)nn(c1C)C(c1nnc(s1)Nc1ccn(n1)Cc1ccccc1)C
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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/c1-12-17(27(28)29)13(2)26(23-12)14(3)18-21-22-19(30-18)20-16-9-10-25(24-16)11-15-7-5-4-6-8-15/h4-10,14H,11H2,1-3H3,(H,20,22,24)InChIKey
IHPNMLXXXZHORF-UHFFFAOYSA-NSynonyms
1005622-76-3(O)(N+)(=O)c1c(C)nn(c1C)C(c1nnc(s1)Nc1ccn(n1)Cc1ccccc1)C
1005622763
CC1=C(C(=NN1C(C)C2=NN=C(S2)NC3=NN(C=C3)CC4=CC=CC=C4)C)(N+)(=O)(O)
InChI=1SC19H20N8O2Sc11217(27(28)29)13(2)26(2312)14(3)18212219(3018)201691025(2416)11157546815h41014H11H213H3(H202224)
MFCD04139777
N(1benzyl1Hpyrazol3yl)5(1(35dimethyl4nitro1Hpyrazol1yl)ethyl)134thiadiazol2amine
N(1benzylpyrazol3yl)5(1(35dimethyl4nitropyrazol1yl)ethyl)134thiadiazol2amine
ZINC000002730106
ZINC000002730107
ZINC02730106
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