Vitas-M small molecule compound
(2Z)-3-(ethoxycarbonyl)-2-[(1-methyl-1H-indol-3-yl)methylidene]-4,4-diphenylbut-3-enoic acid
Catalog ID
STK536664
SMILES CCOC(=O)/C(=C(/c1ccccc1)\c1ccccc1)/C(=C/c1cn(c2c1cccc2)C)/C(=O)O
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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 C29H25NO4 MW 451.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25NO4/c1-3-34-29(33)27(26(20-12-6-4-7-13-20)21-14-8-5-9-15-21)24(28(31)32)18-22-19-30(2)25-17-11-10-16-23(22)25/h4-19H,3H2,1-2H3,(H,31,32)/b24-18-InChIKey
QQRKDJWKXNSDRH-MOHJPFBDSA-NSynonyms
(2Z)3(ethoxycarbonyl)2((1methyl1Hindol3yl)methylidene)44diphenylbut3enoicacid
(2Z)3ETHOXYCARBONYL2((1METHYLINDOL3YL)METHYLIDENE)44DIPHENYLBUT3ENOICACID
(Z)3(ethoxycarbonyl)2((1methyl1Hindol3yl)methylene)44diphenylbut3enoicacid
CCOC(=O)C(=C(C1=CC=CC=C1)C2=CC=CC=C2)C(=CC3=CN(C4=CC=CC=C43)C)C(=O)O
CCOC(=O)C(=C(c1ccccc1)c1ccccc1)C(=Cc1cn(c2c1cccc2)C)C(=O)O
InChI=1SC29H25NO4c133429(33)27(26(20126471320)21148591521)24(28(31)32)18221930(2)251711101623(22)25h419H3H212H3(H3132)b2418
MFCD02163889
ZINC000002291405
ZINC2291405
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