Vitas-M small molecule compound
ethyl 4-[4-methoxy-3-(methoxymethyl)phenyl]-6-[(4-nitro-1H-pyrazol-1-yl)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL396261
SMILES CCOC(=O)C1=C(NC(=O)NC1c1ccc(c(c1)COC)OC)Cn1ncc(c1)[N+](=O)[O-]
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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 C20H23N5O7 MW 445.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O7/c1-4-32-19(26)17-15(10-24-9-14(8-21-24)25(28)29)22-20(27)23-18(17)12-5-6-16(31-3)13(7-12)11-30-2/h5-9,18H,4,10-11H2,1-3H3,(H2,22,23,27)InChIKey
GIRCDECMNUUUSX-UHFFFAOYSA-NSynonyms
1005578-67-51005578675
CCOC(=O)C1=C(NC(=O)NC1c1ccc(c(c1)COC)OC)Cn1ncc(c1)(N+)(=O)(O)
CCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C=C2)OC)COC)CN3C=C(C=N3)(N+)(=O)(O)
ethyl4(4methoxy3(methoxymethyl)phenyl)6((4nitro1Hpyrazol1yl)methyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl4(4methoxy3(methoxymethyl)phenyl)6((4nitropyrazol1yl)methyl)2oxo34dihydro1Hpyrimidine5carboxylate
ETHYL6(4METHOXY3(METHOXYMETHYL)PHENYL)4((4NITROPYRAZOLYL)METHYL)2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC20H23N5O7c143219(26)1715(1024914(82124)25(28)29)2220(27)2318(17)125616(313)13(712)11302h5918H41011H213H3(H2222327)
MFCD05667813
ZINC000008782639
ZINC000008782640
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