Vitas-M small molecule compound
methyl 4-{[(2E)-3-(3,4-diethoxyphenyl)-2-{[(2-methylphenyl)carbonyl]amino}prop-2-enoyl]amino}benzoate
Catalog ID
STK553773
SMILES CCOc1cc(ccc1OCC)/C=C(\C(=O)Nc1ccc(cc1)C(=O)OC)/NC(=O)c1ccccc1C
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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 C29H30N2O6 MW 502.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O6/c1-5-36-25-16-11-20(18-26(25)37-6-2)17-24(31-27(32)23-10-8-7-9-19(23)3)28(33)30-22-14-12-21(13-15-22)29(34)35-4/h7-18H,5-6H2,1-4H3,(H,30,33)(H,31,32)/b24-17+InChIKey
LPIULOTWAXYKGL-JJIBRWJFSA-NSynonyms
840463-48-1(E)methyl4(3(34diethoxyphenyl)2(2methylbenzamido)acrylamido)benzoate
840463481
CCOC1=C(C=C(C=C1)C=C(C(=O)NC2=CC=C(C=C2)C(=O)OC)NC(=O)C3=CC=CC=C3C)OCC
CCOc1cc(ccc1OCC)C=C(C(=O)Nc1ccc(cc1)C(=O)OC)NC(=O)c1ccccc1C
InChI=1SC29H30N2O6c153625161120(1826(25)3762)1724(3127(32)231087919(23)3)28(33)3022141221(131522)29(34)354h718H56H214H3(H3033)(H3132)b2417+
methyl4(((2E)3(34diethoxyphenyl)2(((2methylphenyl)carbonyl)amino)prop2enoyl)amino)benzoate
METHYL4(((E)3(34DIETHOXYPHENYL)2((2METHYLBENZOYL)AMINO)PROP2ENOYL)AMINO)BENZOATE
MFCD04004727
ZINC000013750135
ZINC13750135
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.