Vitas-M small molecule compound
ethyl 6-{[(1,3-benzodioxol-5-ylmethyl)(pyridin-3-ylcarbonyl)amino]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK687971
SMILES CCOC(=O)C1=C(NC(=O)NC1c1ccc(cc1)OC)CN(C(=O)c1cccnc1)Cc1ccc2c(c1)OCO2
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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 C29H28N4O7 MW 544.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O7/c1-3-38-28(35)25-22(31-29(36)32-26(25)19-7-9-21(37-2)10-8-19)16-33(27(34)20-5-4-12-30-14-20)15-18-6-11-23-24(13-18)40-17-39-23/h4-14,26H,3,15-17H2,1-2H3,(H2,31,32,36)InChIKey
LPOPDQMNJZBVDP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)CN(CC3=CC4=C(C=C3)OCO4)C(=O)C5=CN=CC=C5
ethyl6(((13benzodioxol5ylmethyl)(pyridin3ylcarbonyl)amino)methyl)4(4methoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6((13BENZODIOXOL5YLMETHYL(PYRIDINE3CARBONYL)AMINO)METHYL)4(4METHOXYPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC29H28N4O7c133828(35)2522(3129(36)3226(25)197921(372)10819)1633(27(34)205412301420)15186112324(1318)40173923h41426H31517H212H3(H2313236)
MFCD07022518
ZINC000098008906
ZINC000098008907
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