Vitas-M small molecule compound
(2E)-3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-(4-fluorophenyl)prop-2-enamide
Catalog ID
STL168268
SMILES N#C/C(=C\c1cn(c2c1cccc2)CCOc1ccc(c(c1)C)Cl)/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 C27H21ClFN3O2 MW 473.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21ClFN3O2/c1-18-14-23(10-11-25(18)28)34-13-12-32-17-20(24-4-2-3-5-26(24)32)15-19(16-30)27(33)31-22-8-6-21(29)7-9-22/h2-11,14-15,17H,12-13H2,1H3,(H,31,33)/b19-15+InChIKey
YEGIMXZMVFJITG-XDJHFCHBSA-NSynonyms
(2E)3(1(2(4chloro3methylphenoxy)ethyl)1Hindol3yl)2cyanoN(4fluorophenyl)prop2enamide
(E)3(1(2(4chloro3methylphenoxy)ethyl)indol3yl)2cyanoN(4fluorophenyl)prop2enamide
CC1=C(C=CC(=C1)OCCN2C=C(C3=CC=CC=C32)C=C(C#N)C(=O)NC4=CC=C(C=C4)F)Cl
InChI=1SC27H21ClFN3O2c1181423(101125(18)28)341312321720(24423526(24)32)1519(1630)27(33)31228621(29)7922h211141517H1213H21H3(H3133)b1915+
MFCD02196899
N#CC(=Cc1cn(c2c1cccc2)CCOc1ccc(c(c1)C)Cl)C(=O)Nc1ccc(cc1)F
ZINC000015931751
ZINC15931751
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