Vitas-M small molecule compound
ethyl 1-ethyl-2-oxo-4-phenyl-6-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK313415
SMILES CCOC(=O)C1=C(CN2CCN(CC2)c2cccc(c2)C(F)(F)F)N(C(=O)NC1c1ccccc1)CC
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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 C27H31F3N4O3 MW 516.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31F3N4O3/c1-3-34-22(23(25(35)37-4-2)24(31-26(34)36)19-9-6-5-7-10-19)18-32-13-15-33(16-14-32)21-12-8-11-20(17-21)27(28,29)30/h5-12,17,24H,3-4,13-16,18H2,1-2H3,(H,31,36)InChIKey
LPVSNAYIMVJGFS-UHFFFAOYSA-NSynonyms
832741-41-0832741410
CCN1C(=C(C(NC1=O)C2=CC=CC=C2)C(=O)OCC)CN3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F
ethyl1ethyl2oxo4phenyl6((4(3(trifluoromethyl)phenyl)piperazin1yl)methyl)1234tetrahydropyrimidine5carboxylate
ethyl3ethyl2oxo6phenyl4((4(3(trifluoromethyl)phenyl)piperazin1yl)methyl)16dihydropyrimidine5carboxylate
InChI=1SC27H31F3N4O3c133422(23(25(35)3742)24(3126(34)36)1996571019)1832131533(161432)211281120(1721)27(2829)30h5121724H34131618H212H3(H3136)
MFCD05667211
ZINC000013960421
ZINC000013960422
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