Vitas-M small molecule compound
ethyl 4-(4-chlorophenyl)-6-{[4-(2-cyanoethyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK683636
SMILES CCOC(=O)C1=C(CN2CCN(CC2)CCC#N)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 C21H26ClN5O3 MW 431.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26ClN5O3/c1-2-30-20(28)18-17(14-27-12-10-26(11-13-27)9-3-8-23)24-21(29)25-19(18)15-4-6-16(22)7-5-15/h4-7,19H,2-3,9-14H2,1H3,(H2,24,25,29)InChIKey
IRVQBFFDIRCLON-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)Cl)CN3CCN(CC3)CCC#N
ethyl4(4chlorophenyl)6((4(2cyanoethyl)piperazin1yl)methyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL4(4CHLOROPHENYL)6((4(2CYANOETHYL)PIPERAZIN1YL)METHYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC21H26ClN5O3c123020(28)1817(1427121026(111327)93823)2421(29)2519(18)154616(22)7515h4719H23914H21H3(H2242529)
MFCD05258440
ZINC000022917717
ZINC000022917722
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