Vitas-M small molecule compound
2-[(E)-{2-[(3-fluorophenyl)carbonyl]hydrazinylidene}methyl]phenyl 1,3-benzodioxole-5-carboxylate
Catalog ID
STK165846
SMILES Fc1cccc(c1)C(=O)N/N=C/c1ccccc1OC(=O)c1ccc2c(c1)OCO2
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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 C22H15FN2O5 MW 406.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15FN2O5/c23-17-6-3-5-14(10-17)21(26)25-24-12-16-4-1-2-7-18(16)30-22(27)15-8-9-19-20(11-15)29-13-28-19/h1-12H,13H2,(H,25,26)/b24-12+InChIKey
LYZYSDXWWKZWHH-WYMPLXKRSA-NSynonyms
(2((E)((3FLUOROBENZOYL)HYDRAZINYLIDENE)METHYL)PHENYL)13BENZODIOXOLE5CARBOXYLATE
2((E)(2((3FLUOROPHENYL)CARBONYL)HYDRAZINYLIDENE)METHYL)PHENYL13BENZODIOXOLE5CARBOXYLATE
2(2(3FLUOROBENZOYL)CARBOHYDRAZONOYL)PHENYL13BENZODIOXOLE5CARBOXYLATE
C1OC2=C(O1)C=C(C=C2)C(=O)OC3=CC=CC=C3C=NNC(=O)C4=CC(=CC=C4)F
Fc1cccc(c1)C(=O)NN=Cc1ccccc1OC(=O)c1ccc2c(c1)OCO2
InChI=1SC22H15FN2O5c231763514(1017)21(26)25241216412718(16)3022(27)15891920(1115)29132819h112H13H2(H2526)b2412+
MFCD01240311
ZINC000000713883
ZINC33336098
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