Vitas-M small molecule compound
1,3-benzodioxol-5-ylmethyl 4-(2-ethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK008449
SMILES CCOc1ccccc1C1NC(=O)NC(=C1C(=O)OCc1ccc2c(c1)OCO2)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 C22H22N2O6 MW 410.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O6/c1-3-27-16-7-5-4-6-15(16)20-19(13(2)23-22(26)24-20)21(25)28-11-14-8-9-17-18(10-14)30-12-29-17/h4-10,20H,3,11-12H2,1-2H3,(H2,23,24,26)InChIKey
KBDOSEYWQRLZPH-UHFFFAOYSA-NSynonyms
13benzodioxol5ylmethyl4(2ethoxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
13BENZODIOXOL5YLMETHYL4(2ETHOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
2HBENZO(34D)13DIOXOLAN5YLMETHYL6(2ETHOXYPHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
CCOC1=CC=CC=C1C2C(=C(NC(=O)N2)C)C(=O)OCC3=CC4=C(C=C3)OCO4
CCOc1ccccc1C1NC(=O)NC(=C1C(=O)OCc1ccc2c(c1)OCO2)C
InChI=1SC22H22N2O6c132716754615(16)2019(13(2)2322(26)2420)21(25)281114891718(1014)30122917h41020H31112H212H3(H2232426)
MFCD01192322
STK008449
ZINC000001189396
ZINC000001189398
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