Vitas-M small molecule compound
ethyl [1-methyl-9-(3-methylphenyl)-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Catalog ID
STL003386
SMILES CCOC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1)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 C20H23N5O4 MW 397.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O4/c1-4-29-15(26)12-25-18(27)16-17(22(3)20(25)28)21-19-23(9-6-10-24(16)19)14-8-5-7-13(2)11-14/h5,7-8,11H,4,6,9-10,12H2,1-3H3InChIKey
AVXUSTYEKSWTNK-UHFFFAOYSA-NSynonyms
847178-55-6847178556
CCOC(=O)CN1C(=O)C2=C(N=C3N2CCCN3C4=CC=CC(=C4)C)N(C1=O)C
ethyl(1methyl9(3methylphenyl)24dioxo146789hexahydropyrimido(21f)purin3(2H)yl)acetate
ethyl2(1methyl24dioxo9(mtolyl)126789hexahydropyrimido(21f)purin3(4H)yl)acetate
ETHYL2(1METHYL9(3METHYLPHENYL)24DIOXO135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURIN3YL)ACETATE
ETHYL2(1METHYL9(3METHYLPHENYL)24DIOXO78DIHYDRO6HPURINO(78A)PYRIMIDIN3YL)ACETATE
InChI=1SC20H23N5O4c142915(26)122518(27)1617(22(3)20(25)28)211923(961024(16)19)1485713(2)1114h57811H4691012H213H3
MFCD04183976
ZINC000008653904
ZINC08653904
ZINC8653904
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