Vitas-M small molecule compound

(2E)-3-(3-chloro-4-methoxyphenyl)-2-cyano-N-(2-methoxy-4-nitrophenyl)prop-2-enamide

Catalog ID
STK522804
SMILES N#C/C(=C\c1ccc(c(c1)Cl)OC)/C(=O)Nc1ccc(cc1OC)[N+](=O)[O-]

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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 C18H14ClN3O5 MW 387.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14ClN3O5/c1-26-16-6-3-11(8-14(16)19)7-12(10-20)18(23)21-15-5-4-13(22(24)25)9-17(15)27-2/h3-9H,1-2H3,(H,21,23)/b12-7+
InChIKey
UPHUCHBORZXSJV-KPKJPENVSA-N
Synonyms

(2E)3(3chloro4methoxyphenyl)2cyanoN(2methoxy4nitrophenyl)prop2enamide
(E)3(3CHLORO4METHOXYPHENYL)2CYANON(2METHOXY4NITROPHENYL)PROP2ENAMIDE
COC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=C(C=C(C=C2)(N+)(=O)(O))OC)Cl
InChI=1SC18H14ClN3O5c126166311(814(16)19)712(1020)18(23)21155413(22(24)25)917(15)272h39H12H3(H2123)b127+
MFCD03155125
N#CC(=Cc1ccc(c(c1)Cl)OC)C(=O)Nc1ccc(cc1OC)(N+)(=O)(O)
ZINC000004618109
ZINC04618109
ZINC4618109

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Available files

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