Vitas-M small molecule compound

methyl 6-{[4-(2-ethoxyphenyl)piperazin-1-yl]methyl}-4-(4-ethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL027883
SMILES CCOc1ccccc1N1CCN(CC1)CC1=C(C(=O)OC)C(NC(=O)N1)c1ccc(cc1)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 C27H34N4O4 MW 478.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4O4/c1-4-19-10-12-20(13-11-19)25-24(26(32)34-3)21(28-27(33)29-25)18-30-14-16-31(17-15-30)22-8-6-7-9-23(22)35-5-2/h6-13,25H,4-5,14-18H2,1-3H3,(H2,28,29,33)
InChIKey
OXNAVZYAQUYVHA-UHFFFAOYSA-N
Synonyms

CCC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCN(CC3)C4=CC=CC=C4OCC)C(=O)OC
InChI=1SC27H34N4O4c1419101220(131119)2524(26(32)343)21(2827(33)2925)1830141631(171530)22867923(22)3552h61325H451418H213H3(H2282933)
methyl6((4(2ethoxyphenyl)piperazin1yl)methyl)4(4ethylphenyl)2oxo1234tetrahydropyrimidine5carboxylate
methyl6((4(2ethoxyphenyl)piperazin1yl)methyl)4(4ethylphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
MFCD18188474
ZINC000057415241
ZINC000057415243

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Available files

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