Vitas-M small molecule compound
1,3-benzodioxol-5-ylmethyl 4-(2,3-dimethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK363640
SMILES COc1cccc(c1OC)C1NC(=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 C22H22N2O7 MW 426.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O7/c1-12-18(21(25)29-10-13-7-8-15-17(9-13)31-11-30-15)19(24-22(26)23-12)14-5-4-6-16(27-2)20(14)28-3/h4-9,19H,10-11H2,1-3H3,(H2,23,24,26)InChIKey
MWWPLZWCFPJMRL-UHFFFAOYSA-NSynonyms
330850-79-813benzodioxol5ylmethyl4(23dimethoxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
13BENZODIOXOL5YLMETHYL4(23DIMETHOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
330850798
CC1=C(C(NC(=O)N1)C2=C(C(=CC=C2)OC)OC)C(=O)OCC3=CC4=C(C=C3)OCO4
InChI=1SC22H22N2O7c11218(21(25)291013781517(913)31113015)19(2422(26)2312)1454616(272)20(14)283h4919H1011H213H3(H2232426)
MFCD01192236
ZINC000000715177
ZINC000000715178
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