Vitas-M small molecule compound
3-methylcyclohexyl 4-(3-bromo-4-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK373113
SMILES COc1ccc(cc1Br)C1NC(=O)NC(=C1C(=O)OC1CCCC(C1)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 C20H25BrN2O4 MW 437.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25BrN2O4/c1-11-5-4-6-14(9-11)27-19(24)17-12(2)22-20(25)23-18(17)13-7-8-16(26-3)15(21)10-13/h7-8,10-11,14,18H,4-6,9H2,1-3H3,(H2,22,23,25)InChIKey
VWISBCSFWODKEL-UHFFFAOYSA-NSynonyms
(3METHYLCYCLOHEXYL)4(3BROMO4METHOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
3methylcyclohexyl4(3bromo4methoxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
3METHYLCYCLOHEXYL6(3BROMO4METHOXYPHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
CC1CCCC(C1)OC(=O)C2=C(NC(=O)NC2C3=CC(=C(C=C3)OC)Br)C
InChI=1SC20H25BrN2O4c11154614(911)2719(24)1712(2)2220(25)2318(17)137816(263)15(21)1013h7810111418H469H213H3(H2222325)
MFCD00626232
ZINC000000973327
ZINC000101099619
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