Vitas-M small molecule compound

(2E)-N-{3-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl}-3-(4-methoxyphenyl)prop-2-enamide

Catalog ID
STK729552
SMILES COc1ccc(cc1)/C=C/C(=O)Nc1cccc(c1N1CCN(CC1)C(=O)C(C)C)Cl

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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 C24H28ClN3O3 MW 441.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28ClN3O3/c1-17(2)24(30)28-15-13-27(14-16-28)23-20(25)5-4-6-21(23)26-22(29)12-9-18-7-10-19(31-3)11-8-18/h4-12,17H,13-16H2,1-3H3,(H,26,29)/b12-9+
InChIKey
BCVGDDGCJKSWGM-FMIVXFBMSA-N
Synonyms
929821-93-2
(2E)N(3chloro2(4(2methylpropanoyl)piperazin1yl)phenyl)3(4methoxyphenyl)prop2enamide
(E)N(3chloro2(4(2methylpropanoyl)piperazin1yl)phenyl)3(4methoxyphenyl)prop2enamide
(E)N(3chloro2(4isobutyrylpiperazin1yl)phenyl)3(4methoxyphenyl)acrylamide
929821932
CC(C)C(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C=CC3=CC=C(C=C3)OC
COc1ccc(cc1)C=CC(=O)Nc1cccc(c1N1CCN(CC1)C(=O)C(C)C)Cl
InChI=1SC24H28ClN3O3c117(2)24(30)28151327(141628)2320(25)54621(23)2622(29)1291871019(313)11818h41217H1316H213H3(H2629)b129+
MFCD08572014
ZINC000008904432
ZINC08904432
ZINC8904432

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Available files

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