Vitas-M small molecule compound

butyl [9-(4-ethoxyphenyl)-7-hydroxy-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate

Catalog ID
STL321348
SMILES CCCCOC(=O)Cn1c(=O)c2n3CC(O)CN(c3nc2n(c1=O)C)c1ccc(cc1)OCC

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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 C23H29N5O6 MW 471.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N5O6/c1-4-6-11-34-18(30)14-28-21(31)19-20(25(3)23(28)32)24-22-26(12-16(29)13-27(19)22)15-7-9-17(10-8-15)33-5-2/h7-10,16,29H,4-6,11-14H2,1-3H3
InChIKey
AJXBNSTZONWBHF-UHFFFAOYSA-N
Synonyms
300806-46-6
300806466
butyl(9(4ethoxyphenyl)7hydroxy1methyl24dioxo146789hexahydropyrimido(21f)purin3(2H)yl)acetate
butyl2(9(4ethoxyphenyl)7hydroxy1methyl24dioxo126789hexahydropyrimido(21f)purin3(4H)yl)acetate
BUTYL2(9(4ETHOXYPHENYL)7HYDROXY1METHYL24DIOXO78DIHYDRO6HPURINO(78A)PYRIMIDIN3YL)ACETATE
CCCCOC(=O)CN1C(=O)C2=C(N=C3N2CC(CN3C4=CC=C(C=C4)OCC)O)N(C1=O)C
InChI=1SC23H29N5O6c146113418(30)142821(31)1920(25(3)23(28)32)242226(1216(29)1327(19)22)157917(10815)3352h7101629H461114H213H3

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Available files

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