Vitas-M small molecule compound
ethyl 4-[3-(2-methoxyethyl)-1-methyl-2,4-dioxo-1,2,3,4,7,8-hexahydropyrimido[2,1-f]purin-9(6H)-yl]benzoate
Catalog ID
STK589480
SMILES COCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)C(=O)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 C21H25N5O5 MW 427.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O5/c1-4-31-19(28)14-6-8-15(9-7-14)24-10-5-11-25-16-17(22-20(24)25)23(2)21(29)26(18(16)27)12-13-30-3/h6-9H,4-5,10-13H2,1-3H3InChIKey
LTIWNDPMFIGTIA-UHFFFAOYSA-NSynonyms
893956-39-3893956393
CCOC(=O)C1=CC=C(C=C1)N2CCCN3C2=NC4=C3C(=O)N(C(=O)N4C)CCOC
ethyl4(3(2methoxyethyl)1methyl24dioxo123478hexahydropyrimido(21f)purin9(6H)yl)benzoate
ETHYL4(3(2METHOXYETHYL)1METHYL24DIOXO135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURIN9YL)BENZOATE
ETHYL4(3(2METHOXYETHYL)1METHYL24DIOXO78DIHYDRO6HPURINO(78A)PYRIMIDIN9YL)BENZOATE
InChI=1SC21H25N5O5c143119(28)146815(9714)2410511251617(2220(24)25)23(2)21(29)26(18(16)27)1213303h69H451013H213H3
MFCD06601099
ZINC000008704281
ZINC08704281
ZINC8704281
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