Vitas-M small molecule compound
methyl 6-[(4-carbamoylpiperidin-1-yl)methyl]-4-(4-ethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL027870
SMILES COC(=O)C1=C(CN2CCC(CC2)C(=O)N)NC(=O)NC1c1ccc(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 C21H28N4O4 MW 400.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O4/c1-3-13-4-6-14(7-5-13)18-17(20(27)29-2)16(23-21(28)24-18)12-25-10-8-15(9-11-25)19(22)26/h4-7,15,18H,3,8-12H2,1-2H3,(H2,22,26)(H2,23,24,28)InChIKey
XLBKCFTWELHDLM-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCC(CC3)C(=O)N)C(=O)OC
InChI=1SC21H28N4O4c13134614(7513)1817(20(27)292)16(2321(28)2418)122510815(91125)19(22)26h471518H3812H212H3(H22226)(H2232428)
methyl6((4carbamoylpiperidin1yl)methyl)4(4ethylphenyl)2oxo1234tetrahydropyrimidine5carboxylate
methyl6((4carbamoylpiperidin1yl)methyl)4(4ethylphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
MFCD18188461
ZINC000057415172
ZINC000057415173
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