Vitas-M small molecule compound
ethyl 6-{[(3-chloro-4-methylphenyl)amino]methyl}-4-(4-chlorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK776196
SMILES CCOC(=O)C1=C(CNc2ccc(c(c2)Cl)C)NC(=O)NC1c1ccc(cc1)Cl
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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 C21H21Cl2N3O3 MW 434.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21Cl2N3O3/c1-3-29-20(27)18-17(11-24-15-9-4-12(2)16(23)10-15)25-21(28)26-19(18)13-5-7-14(22)8-6-13/h4-10,19,24H,3,11H2,1-2H3,(H2,25,26,28)InChIKey
XUMIGMCWRXJXLE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)Cl)CNC3=CC(=C(C=C3)C)Cl
ethyl6(((3chloro4methylphenyl)amino)methyl)4(4chlorophenyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6((3CHLORO4METHYLANILINO)METHYL)4(4CHLOROPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC21H21Cl2N3O3c132920(27)1817(1124159412(2)16(23)1015)2521(28)2619(18)135714(22)8613h4101924H311H212H3(H2252628)
MFCD05258675
ZINC000001069995
ZINC000001069998
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