Vitas-M small molecule compound

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

Catalog ID
STK729551
SMILES O=C(Nc1cccc(c1N1CCN(CC1)C(=O)C(C)C)Cl)/C=C/c1ccco1

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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 C21H24ClN3O3 MW 401.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN3O3/c1-15(2)21(27)25-12-10-24(11-13-25)20-17(22)6-3-7-18(20)23-19(26)9-8-16-5-4-14-28-16/h3-9,14-15H,10-13H2,1-2H3,(H,23,26)/b9-8+
InChIKey
DNTAQJDIKHKXDA-CMDGGOBGSA-N
Synonyms
929841-88-3
(2E)N(3chloro2(4(2methylpropanoyl)piperazin1yl)phenyl)3(furan2yl)prop2enamide
(E)N(3chloro2(4(2methylpropanoyl)piperazin1yl)phenyl)3(furan2yl)prop2enamide
(E)N(3chloro2(4isobutyrylpiperazin1yl)phenyl)3(furan2yl)acrylamide
929841883
CC(C)C(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C=CC3=CC=CO3
InChI=1SC21H24ClN3O3c115(2)21(27)25121024(111325)2017(22)63718(20)2319(26)981654142816h391415H1013H212H3(H2326)b98+
MFCD08572009
O=C(Nc1cccc(c1N1CCN(CC1)C(=O)C(C)C)Cl)C=Cc1ccco1
ZINC000008904425
ZINC08904425
ZINC8904425

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Available files

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