Vitas-M small molecule compound
2-cyano-3-{4-[(3,4-dichlorophenoxy)methyl]-3-ethoxyphenyl}-N-(3-ethoxyphenyl)propanamide
Catalog ID
STK329786
SMILES CCOc1cc(ccc1COc1ccc(c(c1)Cl)Cl)CC(C(=O)Nc1cccc(c1)OCC)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 C27H26Cl2N2O4 MW 513.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26Cl2N2O4/c1-3-33-22-7-5-6-21(14-22)31-27(32)20(16-30)12-18-8-9-19(26(13-18)34-4-2)17-35-23-10-11-24(28)25(29)15-23/h5-11,13-15,20H,3-4,12,17H2,1-2H3,(H,31,32)InChIKey
UAVMXWFTJIHNGH-UHFFFAOYSA-NSynonyms
2cyano3(4((34dichlorophenoxy)methyl)3ethoxyphenyl)N(3ethoxyphenyl)propanamide
CCOC1=CC=CC(=C1)NC(=O)C(CC2=CC(=C(C=C2)COC3=CC(=C(C=C3)Cl)Cl)OCC)C#N
InChI=1SC27H26Cl2N2O4c13332275621(1422)3127(32)20(1630)12188919(26(1318)3442)173523101124(28)25(29)1523h511131520H341217H212H3(H3132)
MFCD09962060
ZINC000018192485
ZINC000018192488
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