Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(3-chloro-4-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK407168
SMILES COc1ccc(cc1Cl)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 C18H21ClN2O5 MW 380.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClN2O5/c1-10-15(17(22)26-9-12-4-3-7-25-12)16(21-18(23)20-10)11-5-6-14(24-2)13(19)8-11/h5-6,8,12,16H,3-4,7,9H2,1-2H3,(H2,20,21,23)InChIKey
GRYJWVHRWRGSAA-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)OC)Cl)C(=O)OCC3CCCO3
InChI=1SC18H21ClN2O5c11015(17(22)269124372512)16(2118(23)2010)115614(242)13(19)811h5681216H3479H212H3(H2202123)
MFCD07402529
OXOLAN2YLMETHYL4(3CHLORO4METHOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
OXOLAN2YLMETHYL6(3CHLORO4METHOXYPHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
tetrahydrofuran2ylmethyl4(3chloro4methoxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
ZINC000004986965
ZINC000004986971
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