Vitas-M small molecule compound
2,2,2-trichloroethyl 4-[2-(benzyloxy)phenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK092762
SMILES O=C1NC(=C(C(N1)c1ccccc1OCc1ccccc1)C(=O)OCC(Cl)(Cl)Cl)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 C21H19Cl3N2O4 MW 469.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl3N2O4/c1-13-17(19(27)30-12-21(22,23)24)18(26-20(28)25-13)15-9-5-6-10-16(15)29-11-14-7-3-2-4-8-14/h2-10,18H,11-12H2,1H3,(H2,25,26,28)InChIKey
XXEKEVKCEKYURE-UHFFFAOYSA-NSynonyms
222trichloroethyl4(2(benzyloxy)phenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
222TRICHLOROETHYL4METHYL2OXO6(2(PHENYLMETHOXY)PHENYL)136TRIHYDROPYRIMIDINE5CARBOXYLATE
222TRICHLOROETHYL6METHYL2OXO4(2PHENYLMETHOXYPHENYL)34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CC1=C(C(NC(=O)N1)C2=CC=CC=C2OCC3=CC=CC=C3)C(=O)OCC(Cl)(Cl)Cl
InChI=1SC21H19Cl3N2O4c11317(19(27)301221(2223)24)18(2620(28)2513)159561016(15)2911147324814h21018H1112H21H3(H2252628)
MFCD01193431
O=C1NC(=C(C(N1)c1ccccc1OCc1ccccc1)C(=O)OCC(Cl)(Cl)Cl)C
STK092762
ZINC000000861095
ZINC000000861096
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