Vitas-M small molecule compound
(2E)-3-(3-bromo-4-ethoxy-5-methoxyphenyl)-N-(4-chloro-2-nitrophenyl)-2-cyanoprop-2-enamide
Catalog ID
STL382732
SMILES CCOc1c(Br)cc(cc1OC)/C=C(/C(=O)Nc1ccc(cc1[N+](=O)[O-])Cl)\C#N
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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 C19H15BrClN3O5 MW 480.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15BrClN3O5/c1-3-29-18-14(20)7-11(8-17(18)28-2)6-12(10-22)19(25)23-15-5-4-13(21)9-16(15)24(26)27/h4-9H,3H2,1-2H3,(H,23,25)/b12-6+InChIKey
SZTANGSXTUIXRK-WUXMJOGZSA-NSynonyms
(2E)3(3bromo4ethoxy5methoxyphenyl)N(4chloro2nitrophenyl)2cyanoprop2enamide
(E)3(3BROMO4ETHOXY5METHOXYPHENYL)N(4CHLORO2NITROPHENYL)2CYANOPROP2ENAMIDE
CCOC1=C(C=C(C=C1Br)C=C(C#N)C(=O)NC2=C(C=C(C=C2)Cl)(N+)(=O)(O))OC
CCOc1c(Br)cc(cc1OC)C=C(C(=O)Nc1ccc(cc1(N+)(=O)(O))Cl)C#N
InChI=1SC19H15BrClN3O5c13291814(20)711(817(18)282)612(1022)19(25)23155413(21)916(15)24(26)27h49H3H212H3(H2325)b126+
MFCD02731683
ZINC000013387987
ZINC13387987
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