Vitas-M small molecule compound
methyl 4-(3-ethoxy-4-hydroxyphenyl)-6-[(4-methylpiperazin-1-yl)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL107517
SMILES CCOc1cc(ccc1O)C1NC(=O)NC(=C1C(=O)OC)CN1CCN(CC1)C
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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 C20H28N4O5 MW 404.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N4O5/c1-4-29-16-11-13(5-6-15(16)25)18-17(19(26)28-3)14(21-20(27)22-18)12-24-9-7-23(2)8-10-24/h5-6,11,18,25H,4,7-10,12H2,1-3H3,(H2,21,22,27)InChIKey
PHMMZDQHTDHNHB-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C2C(=C(NC(=O)N2)CN3CCN(CC3)C)C(=O)OC)O
InChI=1SC20H28N4O5c1429161113(5615(16)25)1817(19(26)283)14(2120(27)2218)12249723(2)81024h56111825H471012H213H3(H2212227)
methyl4(3ethoxy4hydroxyphenyl)6((4methylpiperazin1yl)methyl)2oxo1234tetrahydropyrimidine5carboxylate
methyl4(3ethoxy4hydroxyphenyl)6((4methylpiperazin1yl)methyl)2oxo34dihydro1Hpyrimidine5carboxylate
MFCD20741465
ZINC000067285674
ZINC000067285675
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