Vitas-M small molecule compound

2-(4-chlorophenyl)-2-oxoethyl N-{(2E)-3-(4-methoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}glycinate

Catalog ID
STK527595
SMILES COc1ccc(cc1)/C=C(\C(=O)NCC(=O)OCC(=O)c1ccc(cc1)Cl)/NC(=O)c1ccccc1

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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 C27H23ClN2O6 MW 506.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23ClN2O6/c1-35-22-13-7-18(8-14-22)15-23(30-26(33)20-5-3-2-4-6-20)27(34)29-16-25(32)36-17-24(31)19-9-11-21(28)12-10-19/h2-15H,16-17H2,1H3,(H,29,34)(H,30,33)/b23-15+
InChIKey
QTNHSWUBHPGMIG-HZHRSRAPSA-N
Synonyms
370076-51-0
(2(4CHLOROPHENYL)2OXOETHYL)2(((E)2BENZAMIDO3(4METHOXYPHENYL)PROP2ENOYL)AMINO)ACETATE
(E)2(4chlorophenyl)2oxoethyl2(2benzamido3(4methoxyphenyl)acrylamido)acetate
2(4CHLOROPHENYL)2OXOETHYL2(2BENZAMIDO3(4METHOXYPHENYL)ACRYLAMIDO)ACETATE
2(4chlorophenyl)2oxoethylN((2E)3(4methoxyphenyl)2((phenylcarbonyl)amino)prop2enoyl)glycinate
370076510
COC1=CC=C(C=C1)C=C(C(=O)NCC(=O)OCC(=O)C2=CC=C(C=C2)Cl)NC(=O)C3=CC=CC=C3
COc1ccc(cc1)C=C(C(=O)NCC(=O)OCC(=O)c1ccc(cc1)Cl)NC(=O)c1ccccc1
InChI=1SC27H23ClN2O6c1352213718(81422)1523(3026(33)205324620)27(34)291625(32)361724(31)1991121(28)121019h215H1617H21H3(H2934)(H3033)b2315+
MFCD00266107
ZINC000013739071
ZINC13739071

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.