Vitas-M small molecule compound

ethyl 5-methoxy-3-{[(2E)-2,3,4,5,5-pentachloropenta-2,4-dienoyl]amino}-1H-indole-2-carboxylate

Catalog ID
STK557936
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)/C(=C(/C(=C(Cl)Cl)Cl)\Cl)/Cl)cc(cc2)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 C17H13Cl5N2O4 MW 486.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13Cl5N2O4/c1-3-28-17(26)14-13(8-6-7(27-2)4-5-9(8)23-14)24-16(25)12(20)10(18)11(19)15(21)22/h4-6,23H,3H2,1-2H3,(H,24,25)/b12-10+
InChIKey
QLDNSAYAVIXBHN-ZRDIBKRKSA-N
Synonyms
577962-60-8
(E)ethyl5methoxy3(23455pentachloropenta24dienamido)1Hindole2carboxylate
577962608
CCOC(=O)c1(nH)c2c(c1NC(=O)C(=C(C(=C(Cl)Cl)Cl)Cl)Cl)cc(cc2)OC
CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)C(=C(C(=C(Cl)Cl)Cl)Cl)Cl
ethyl5methoxy3(((2E)23455pentachloropenta24dienoyl)amino)1Hindole2carboxylate
InChI=1SC17H13Cl5N2O4c132817(26)1413(867(272)459(8)2314)2416(25)12(20)10(18)11(19)15(21)22h4623H3H212H3(H2425)b1210+
MFCD04028735
ZINC000002385150
ZINC02385150
ZINC2385150

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Available files

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