Vitas-M small molecule compound
ethyl 6-({(1,3-benzodioxol-5-ylmethyl)[(4-methoxyphenyl)carbonyl]amino}methyl)-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK687956
SMILES CCOC(=O)C1=C(NC(=O)NC1c1ccc(cc1)OC)CN(C(=O)c1ccc(cc1)OC)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 C31H31N3O8 MW 573.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3O8/c1-4-40-30(36)27-24(32-31(37)33-28(27)20-6-10-22(38-2)11-7-20)17-34(29(35)21-8-12-23(39-3)13-9-21)16-19-5-14-25-26(15-19)42-18-41-25/h5-15,28H,4,16-18H2,1-3H3,(H2,32,33,37)InChIKey
BCOWVWRJFREZJW-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)CN(CC3=CC4=C(C=C3)OCO4)C(=O)C5=CC=C(C=C5)OC
ethyl6(((13benzodioxol5ylmethyl)((4methoxyphenyl)carbonyl)amino)methyl)4(4methoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6((13BENZODIOXOL5YLMETHYL(4METHOXYBENZOYL)AMINO)METHYL)4(4METHOXYPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC31H31N3O8c144030(36)2724(3231(37)3328(27)2061022(382)11720)1734(29(35)2181223(393)13921)16195142526(1519)42184125h51528H41618H213H3(H2323337)
MFCD07022485
ZINC000098008898
ZINC000098008899
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