Vitas-M small molecule compound
ethyl 4-(4-hydroxy-1,7-dimethyl-2-oxo-1,2,7,8-tetrahydropyrimido[2,1-f]purin-9(6H)-yl)benzoate
Catalog ID
STK578752
SMILES CCOC(=O)c1ccc(cc1)N1CC(C)Cn2c1nc1c2c(O)nc(=O)n1C
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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 C19H21N5O4 MW 383.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N5O4/c1-4-28-17(26)12-5-7-13(8-6-12)23-9-11(2)10-24-14-15(20-18(23)24)22(3)19(27)21-16(14)25/h5-8,11H,4,9-10H2,1-3H3,(H,21,25,27)InChIKey
CRKLBPIAYQTGIC-UHFFFAOYSA-NSynonyms
879463-18-0879463180
CCOC(=O)C1=CC=C(C=C1)N2CC(CN3C2=NC4=C3C(=O)NC(=O)N4C)C
ETHYL4(17DIMETHYL24DIOXO135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURIN9YL)BENZOATE
ETHYL4(17DIMETHYL24DIOXO78DIHYDRO6HPURINO(78A)PYRIMIDIN9YL)BENZOATE
ethyl4(4hydroxy17dimethyl2oxo1278tetrahydropyrimido(21f)purin9(6H)yl)benzoate
InChI=1SC19H21N5O4c142817(26)125713(8612)23911(2)10241415(2018(23)24)22(3)19(27)2116(14)25h5811H4910H213H3(H212527)
MFCD07208523
ZINC000012538489
ZINC000012538490
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