Vitas-M small molecule compound
N-[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-4-methoxy-3-nitrobenzamide
Catalog ID
STK316933
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)Nc1c(C)nn(c1C)Cc1ccccc1Cl
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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 C20H19ClN4O4 MW 414.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN4O4/c1-12-19(13(2)24(23-12)11-15-6-4-5-7-16(15)21)22-20(26)14-8-9-18(29-3)17(10-14)25(27)28/h4-10H,11H2,1-3H3,(H,22,26)InChIKey
NBFAHMFVEZJYQK-UHFFFAOYSA-NSynonyms
515175-31-2515175312
CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)NC(=O)C3=CC(=C(C=C3)OC)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)Nc1c(C)nn(c1C)Cc1ccccc1Cl
InChI=1SC20H19ClN4O4c11219(13(2)24(2312)1115645716(15)21)2220(26)148918(293)17(1014)25(27)28h410H11H213H3(H2226)
MFCD03073328
N(1((2CHLOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)4METHOXY3NITROBENZAMIDE
N(1(2chlorobenzyl)35dimethyl1Hpyrazol4yl)4methoxy3nitrobenzamide
ZINC000002763973
ZINC02763973
ZINC2763973
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