Vitas-M small molecule compound
benzyl [8-(2-hydroxyethyl)-1,6,7-trimethyl-2,4-dioxo-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]acetate
Catalog ID
STK646126
SMILES OCCn1c(C)c(n2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)OCc1ccccc1)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 C21H23N5O5 MW 425.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O5/c1-13-14(2)26-17-18(22-20(26)24(13)9-10-27)23(3)21(30)25(19(17)29)11-16(28)31-12-15-7-5-4-6-8-15/h4-8,27H,9-12H2,1-3H3InChIKey
MCNQLNAKBDWNLZ-UHFFFAOYSA-NSynonyms
1010882-37-71010882377
benzyl(8(2hydroxyethyl)167trimethyl24dioxo1248tetrahydro3Himidazo(21f)purin3yl)acetate
benzyl2(6(2hydroxyethyl)478trimethyl13dioxopurino(78a)imidazol2yl)acetate
benzyl2(8(2hydroxyethyl)167trimethyl24dioxo1Himidazo(21f)purin3(2H4H8H)yl)acetate
CC1=C(N2C3=C(N=C2N1CCO)N(C(=O)N(C3=O)CC(=O)OCC4=CC=CC=C4)C)C
InChI=1SC21H23N5O5c11314(2)261718(2220(26)24(13)91027)23(3)21(30)25(19(17)29)1116(28)3112157546815h4827H912H213H3
MFCD12199809
ZINC000012322334
ZINC12322334
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