Vitas-M small molecule compound
2-methoxy-4-[(E)-{2-[(3-methyl-1H-pyrazol-5-yl)carbonyl]hydrazinylidene}methyl]phenyl 2-chlorobenzoate
Catalog ID
STK028174
SMILES COc1cc(/C=N/NC(=O)c2[nH]nc(c2)C)ccc1OC(=O)c1ccccc1Cl
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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 C20H17ClN4O4 MW 412.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN4O4/c1-12-9-16(24-23-12)19(26)25-22-11-13-7-8-17(18(10-13)28-2)29-20(27)14-5-3-4-6-15(14)21/h3-11H,1-2H3,(H,23,24)(H,25,26)/b22-11+InChIKey
SPEBOHTVVHFGBZ-SSDVNMTOSA-NSynonyms
(2methoxy4((E)((5methyl1Hpyrazole3carbonyl)hydrazinylidene)methyl)phenyl)2chlorobenzoate
2METHOXY4((E)(2((3METHYL1HPYRAZOL5YL)CARBONYL)HYDRAZINYLIDENE)METHYL)PHENYL2CHLOROBENZOATE
CC1=CC(=NN1)C(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3Cl)OC
COc1cc(C=NNC(=O)c2(nH)nc(c2)C)ccc1OC(=O)c1ccccc1Cl
InChI=1SC20H17ClN4O4c112916(242312)19(26)252211137817(18(1013)282)2920(27)14534615(14)21h311H12H3(H2324)(H2526)b2211+
MFCD00647999
STK028174
ZINC000018285484
ZINC33344246
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