Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-[3-methoxy-2-(propan-2-yloxy)phenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK406531
SMILES COc1cccc(c1OC(C)C)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 C21H28N2O6 MW 404.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O6/c1-12(2)29-19-15(8-5-9-16(19)26-4)18-17(13(3)22-21(25)23-18)20(24)28-11-14-7-6-10-27-14/h5,8-9,12,14,18H,6-7,10-11H2,1-4H3,(H2,22,23,25)InChIKey
LWMZIZYHRKJGML-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=O)N1)C2=C(C(=CC=C2)OC)OC(C)C)C(=O)OCC3CCCO3
InChI=1SC21H28N2O6c112(2)291915(85916(19)264)1817(13(3)2221(25)2318)20(24)28111476102714h589121418H671011H214H3(H2222325)
MFCD06000498
OXOLAN2YLMETHYL4(3METHOXY2PROPAN2YLOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
OXOLAN2YLMETHYL6(3METHOXY2(METHYLETHOXY)PHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
tetrahydrofuran2ylmethyl4(3methoxy2(propan2yloxy)phenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
ZINC000001075282
ZINC000001075293
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