Vitas-M small molecule compound
(2E)-3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-(4-ethoxyphenyl)prop-2-enamide
Catalog ID
STL168267
SMILES CCOc1ccc(cc1)NC(=O)/C(=C/c1cn(c2c1cccc2)CCOc1ccc(c(c1)C)Cl)/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 C29H26ClN3O3 MW 500.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26ClN3O3/c1-3-35-24-10-8-23(9-11-24)32-29(34)21(18-31)17-22-19-33(28-7-5-4-6-26(22)28)14-15-36-25-12-13-27(30)20(2)16-25/h4-13,16-17,19H,3,14-15H2,1-2H3,(H,32,34)/b21-17+InChIKey
DRGYPBIYGDYZEV-HEHNFIMWSA-NSynonyms
(2E)3(1(2(4chloro3methylphenoxy)ethyl)1Hindol3yl)2cyanoN(4ethoxyphenyl)prop2enamide
(E)3(1(2(4chloro3methylphenoxy)ethyl)indol3yl)2cyanoN(4ethoxyphenyl)prop2enamide
CCOC1=CC=C(C=C1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CCOC4=CC(=C(C=C4)Cl)C)C#N
CCOc1ccc(cc1)NC(=O)C(=Cc1cn(c2c1cccc2)CCOc1ccc(c(c1)C)Cl)C#N
InChI=1SC29H26ClN3O3c13352410823(91124)3229(34)21(1831)17221933(28754626(22)28)14153625121327(30)20(2)1625h413161719H31415H212H3(H3234)b2117+
MFCD02243186
ZINC000002768888
ZINC02768888
ZINC2768888
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