Vitas-M small molecule compound

(2E)-2-cyano-N-propyl-3-(3,4,5-trimethoxyphenyl)prop-2-enamide

Catalog ID
STK089170
SMILES CCCNC(=O)/C(=C/c1cc(OC)c(c(c1)OC)OC)/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 C16H20N2O4 MW 304.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O4/c1-5-6-18-16(19)12(10-17)7-11-8-13(20-2)15(22-4)14(9-11)21-3/h7-9H,5-6H2,1-4H3,(H,18,19)/b12-7+
InChIKey
RHJVAPHCQFXDGJ-KPKJPENVSA-N
Synonyms

(2E)2CYANONPROPYL3(345TRIMETHOXYPHENYL)PROP2ENAMIDE
(E)2CYANONPROPYL3(345TRIMETHOXYPHENYL)PROP2ENAMIDE
CCCNC(=O)C(=CC1=CC(=C(C(=C1)OC)OC)OC)C#N
CCCNC(=O)C(=Cc1cc(OC)c(c(c1)OC)OC)C#N
InChI=1SC16H20N2O4c1561816(19)12(1017)711813(202)15(224)14(911)213h79H56H214H3(H1819)b127+
MFCD04245200
STK089170
ZINC000004673313
ZINC04673313
ZINC4673313

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.