Vitas-M small molecule compound
4-(5-acetyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidin-4-yl)-2-ethoxyphenyl benzoate
Catalog ID
STK958707
SMILES CCOc1cc(ccc1OC(=O)c1ccccc1)C1NC(=O)NC(=C1C(=O)C)C
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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 C22H22N2O5 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O5/c1-4-28-18-12-16(20-19(14(3)25)13(2)23-22(27)24-20)10-11-17(18)29-21(26)15-8-6-5-7-9-15/h5-12,20H,4H2,1-3H3,(H2,23,24,27)InChIKey
JMQYKTSQDQYZLP-UHFFFAOYSA-NSynonyms
494858-27-4(4(5ACETYL6METHYL2OXO34DIHYDRO1HPYRIMIDIN4YL)2ETHOXYPHENYL)BENZOATE
4(5acetyl6methyl2oxo1234tetrahydropyrimidin4yl)2ethoxyphenylbenzoate
494858274
CCOC1=C(C=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)C)OC(=O)C3=CC=CC=C3
InChI=1SC22H22N2O5c1428181216(2019(14(3)25)13(2)2322(27)2420)101117(18)2921(26)158657915h51220H4H213H3(H2232427)
MFCD02605575
ZINC000008254294
ZINC000008254298
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