Vitas-M small molecule compound
(2E)-2-cyano-N-(2,4-dichlorophenyl)-3-[3-methyl-4-(pyrrolidin-1-yl)phenyl]prop-2-enamide
Catalog ID
STK080597
SMILES N#C/C(=C\c1ccc(c(c1)C)N1CCCC1)/C(=O)Nc1ccc(cc1Cl)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 C21H19Cl2N3O MW 400.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl2N3O/c1-14-10-15(4-7-20(14)26-8-2-3-9-26)11-16(13-24)21(27)25-19-6-5-17(22)12-18(19)23/h4-7,10-12H,2-3,8-9H2,1H3,(H,25,27)/b16-11+InChIKey
WQHRRZRNEBMFQK-LFIBNONCSA-NSynonyms
(2E)2CYANON(24DICHLOROPHENYL)3(3METHYL4(PYRROLIDIN1YL)PHENYL)PROP2ENAMIDE
(E)2CYANON(24DICHLOROPHENYL)3(3METHYL4PYRROLIDIN1YLPHENYL)PROP2ENAMIDE
CC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=C(C=C(C=C2)Cl)Cl)N3CCCC3
InChI=1SC21H19Cl2N3Oc1141015(4720(14)26823926)1116(1324)21(27)25196517(22)1218(19)23h471012H2389H21H3(H2527)b1611+
MFCD03244873
N#CC(=Cc1ccc(c(c1)C)N1CCCC1)C(=O)Nc1ccc(cc1Cl)Cl
STK080597
ZINC000004663030
ZINC04663030
ZINC4663030
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