Vitas-M small molecule compound

(2E)-2-cyano-3-(4,5-dimethoxy-2-nitrophenyl)-N-(4-fluorophenyl)prop-2-enamide

Catalog ID
STK183208
SMILES N#C/C(=C\c1cc(OC)c(cc1[N+](=O)[O-])OC)/C(=O)Nc1ccc(cc1)F

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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 C18H14FN3O5 MW 371.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14FN3O5/c1-26-16-8-11(15(22(24)25)9-17(16)27-2)7-12(10-20)18(23)21-14-5-3-13(19)4-6-14/h3-9H,1-2H3,(H,21,23)/b12-7+
InChIKey
ZXHISSNWOUAOOK-KPKJPENVSA-N
Synonyms

(2E)2CYANO3(45DIMETHOXY2NITROPHENYL)N(4FLUOROPHENYL)PROP2ENAMIDE
(E)2CYANO3(45DIMETHOXY2NITROPHENYL)N(4FLUOROPHENYL)PROP2ENAMIDE
COC1=C(C=C(C(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)F)(N+)(=O)(O))OC
InChI=1SC18H14FN3O5c12616811(15(22(24)25)917(16)272)712(1020)18(23)21145313(19)4614h39H12H3(H2123)b127+
MFCD01829373
N#CC(=Cc1cc(OC)c(cc1(N+)(=O)(O))OC)C(=O)Nc1ccc(cc1)F
ZINC000001191381
ZINC01191381
ZINC1191381

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Available files

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