Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK074378
SMILES COc1cc(ccc1O)C1NC(=O)NC(=C1C(=O)OCC1CCCO1)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 C18H22N2O6 MW 362.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O6/c1-10-15(17(22)26-9-12-4-3-7-25-12)16(20-18(23)19-10)11-5-6-13(21)14(8-11)24-2/h5-6,8,12,16,21H,3-4,7,9H2,1-2H3,(H2,19,20,23)InChIKey
IRNWOUFPLWFKBW-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)O)OC)C(=O)OCC3CCCO3
COc1cc(ccc1O)C1NC(=O)NC(=C1C(=O)OCC1CCCO1)C
InChI=1SC18H22N2O6c11015(17(22)269124372512)16(2018(23)1910)115613(21)14(811)242h568121621H3479H212H3(H2192023)
MFCD01192494
oxolan2ylmethyl4(4hydroxy3methoxyphenyl)6methyl2oxo34dihydro1Hpyrimidine5carboxylate
STK074378
tetrahydrofuran2ylmethyl4(4hydroxy3methoxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
ZINC000000909317
ZINC000000909325
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