Vitas-M small molecule compound
methyl 6-methoxy-3-{[(2E)-2,3,4,5,5-pentachloropenta-2,4-dienoyl]amino}-1H-indole-2-carboxylate
Catalog ID
STK558036
SMILES COC(=O)c1[nH]c2c(c1NC(=O)/C(=C(/C(=C(Cl)Cl)Cl)\Cl)/Cl)ccc(c2)OC
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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 C16H11Cl5N2O4 MW 472.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11Cl5N2O4/c1-26-6-3-4-7-8(5-6)22-13(16(25)27-2)12(7)23-15(24)11(19)9(17)10(18)14(20)21/h3-5,22H,1-2H3,(H,23,24)/b11-9+InChIKey
NAXWTUICFGCIKX-PKNBQFBNSA-NSynonyms
578719-62-7(E)methyl6methoxy3(23455pentachloropenta24dienamido)1Hindole2carboxylate
578719627
COC(=O)c1(nH)c2c(c1NC(=O)C(=C(C(=C(Cl)Cl)Cl)Cl)Cl)ccc(c2)OC
COC1=CC2=C(C=C1)C(=C(N2)C(=O)OC)NC(=O)C(=C(C(=C(Cl)Cl)Cl)Cl)Cl
InChI=1SC16H11Cl5N2O4c12663478(56)2213(16(25)272)12(7)2315(24)11(19)9(17)10(18)14(20)21h3522H12H3(H2324)b119+
methyl6methoxy3(((2E)23455pentachloropenta24dienoyl)amino)1Hindole2carboxylate
MFCD04029562
ZINC000002387968
ZINC02387968
ZINC2387968
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