Vitas-M small molecule compound
ethyl 6-{[4-(1,3-benzoxazol-2-yl)piperazin-1-yl]methyl}-4-(4-chlorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK776058
SMILES CCOC(=O)C1=C(CN2CCN(CC2)c2nc3c(o2)cccc3)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 C25H26ClN5O4 MW 495.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClN5O4/c1-2-34-23(32)21-19(27-24(33)29-22(21)16-7-9-17(26)10-8-16)15-30-11-13-31(14-12-30)25-28-18-5-3-4-6-20(18)35-25/h3-10,22H,2,11-15H2,1H3,(H2,27,29,33)InChIKey
AIXVSUKXHKEQNL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)Cl)CN3CCN(CC3)C4=NC5=CC=CC=C5O4
ethyl6((4(13benzoxazol2yl)piperazin1yl)methyl)4(4chlorophenyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6((4(13BENZOXAZOL2YL)PIPERAZIN1YL)METHYL)4(4CHLOROPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC25H26ClN5O4c123423(32)2119(2724(33)2922(21)167917(26)10816)1530111331(141230)252818534620(18)3525h31022H21115H21H3(H2272933)
MFCD05258446
ZINC000012412547
ZINC000019857907
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