Vitas-M small molecule compound
ethyl 5-{2-[(2E)-2-(3-chlorobenzylidene)hydrazinyl]-2-oxoethoxy}-1,2-dimethyl-1H-indole-3-carboxylate
Catalog ID
STK552240
SMILES CCOC(=O)c1c(C)n(c2c1cc(OCC(=O)N/N=C/c1cccc(c1)Cl)cc2)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 C22H22ClN3O4 MW 427.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O4/c1-4-29-22(28)21-14(2)26(3)19-9-8-17(11-18(19)21)30-13-20(27)25-24-12-15-6-5-7-16(23)10-15/h5-12H,4,13H2,1-3H3,(H,25,27)/b24-12+InChIKey
KAJQJTPYLNLTNK-WYMPLXKRSA-NSynonyms
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)NN=CC3=CC(=CC=C3)Cl)C)C
CCOC(=O)c1c(C)n(c2c1cc(OCC(=O)NN=Cc1cccc(c1)Cl)cc2)C
ETHYL5(2((2E)2((3CHLOROPHENYL)METHYLIDENE)HYDRAZINYL)2OXOETHOXY)12DIMETHYLINDOLE3CARBOXYLATE
ethyl5(2((2E)2(3chlorobenzylidene)hydrazinyl)2oxoethoxy)12dimethyl1Hindole3carboxylate
ethyl5(2(2(3chlorobenzylidene)hydrazinyl)2oxoethoxy)12dimethyl1Hindole3carboxylate
InChI=1SC22H22ClN3O4c142922(28)2114(2)26(3)199817(1118(19)21)301320(27)2524121565716(23)1015h512H413H213H3(H2527)b2412+
MFCD03130686
ZINC000002224047
ZINC33350913
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