Vitas-M small molecule compound
2-({(2E)-2-cyano-3-[3-ethoxy-4-(naphthalen-1-ylmethoxy)phenyl]prop-2-enoyl}amino)benzoic acid
Catalog ID
STK033234
SMILES CCOc1cc(ccc1OCc1cccc2c1cccc2)/C=C(/C(=O)Nc1ccccc1C(=O)O)\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 C30H24N2O5 MW 492.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24N2O5/c1-2-36-28-17-20(16-23(18-31)29(33)32-26-13-6-5-12-25(26)30(34)35)14-15-27(28)37-19-22-10-7-9-21-8-3-4-11-24(21)22/h3-17H,2,19H2,1H3,(H,32,33)(H,34,35)/b23-16+InChIKey
QKXHDGGETFOYAO-XQNSMLJCSA-NSynonyms
345241-82-92(((2E)2CYANO3(3ETHOXY4(NAPHTHALEN1YLMETHOXY)PHENYL)PROP2ENOYL)AMINO)BENZOICACID
2(((E)2CYANO3(3ETHOXY4(NAPHTHALEN1YLMETHOXY)PHENYL)PROP2ENOYL)AMINO)BENZOICACID
345241829
CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC=C2C(=O)O)OCC3=CC=CC4=CC=CC=C43
CCOc1cc(ccc1OCc1cccc2c1cccc2)C=C(C(=O)Nc1ccccc1C(=O)O)C#N
InChI=1SC30H24N2O5c1236281720(1623(1831)29(33)322613651225(26)30(34)35)141527(28)3719221079218341124(21)22h317H219H21H3(H3233)(H3435)b2316+
MFCD02373904
STK033234
ZINC000002774443
ZINC2774443
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