Vitas-M small molecule compound
1,3-benzodioxol-5-ylmethyl 6-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK363771
SMILES O=C1NC(=C(C(N1)c1cccc(c1)Oc1ccccc1)C(=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 C26H22N2O6 MW 458.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O6/c1-16-23(25(29)31-14-17-10-11-21-22(12-17)33-15-32-21)24(28-26(30)27-16)18-6-5-9-20(13-18)34-19-7-3-2-4-8-19/h2-13,24H,14-15H2,1H3,(H2,27,28,30)InChIKey
CGGKDCONHFXQRO-UHFFFAOYSA-NSynonyms
13benzodioxol5ylmethyl6methyl2oxo4(3phenoxyphenyl)1234tetrahydropyrimidine5carboxylate
13BENZODIOXOL5YLMETHYL6METHYL2OXO4(3PHENOXYPHENYL)34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
2HBENZO(34D)13DIOXOLAN5YLMETHYL4METHYL2OXO6(3PHENOXYPHENYL)136TRIHYDROPYRIMIDINE5CARBOXYLATE
CC1=C(C(NC(=O)N1)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)OCC4=CC5=C(C=C4)OCO5
InChI=1SC26H22N2O6c11623(25(29)31141710112122(1217)33153221)24(2826(30)2716)1865920(1318)34197324819h21324H1415H21H3(H2272830)
MFCD01193147
ZINC000000861175
ZINC000000861176
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