Vitas-M small molecule compound
5-(6-amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-6-(1,3-benzodioxol-5-yl)-1,3-dimethyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Catalog ID
STK784544
SMILES O=c1c2c(c([nH]c2n(c(=O)n1C)C)c1ccc2c(c1)OCO2)c1c(N)n(C)c(=O)n(c1=O)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 C21H20N6O6 MW 452.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O6/c1-24-16(22)13(18(28)26(3)20(24)30)12-14-17(25(2)21(31)27(4)19(14)29)23-15(12)9-5-6-10-11(7-9)33-8-32-10/h5-7,23H,8,22H2,1-4H3InChIKey
BNLIUHFSOLKKQV-UHFFFAOYSA-NSynonyms
5(4AMINO13DIMETHYL26DIOXOPYRIMIDIN5YL)6(13BENZODIOXOL5YL)13DIMETHYL7HPYRROLO(23D)PYRIMIDINE24DIONE
5(6amino13dimethyl24dioxo1234tetrahydropyrimidin5yl)6(13benzodioxol5yl)13dimethyl1Hpyrrolo(23d)pyrimidine24(3H7H)dione
CN1C(=C(C(=O)N(C1=O)C)C2=C(NC3=C2C(=O)N(C(=O)N3C)C)C4=CC5=C(C=C4)OCO5)N
InChI=1SC21H20N6O6c12416(22)13(18(28)26(3)20(24)30)121417(25(2)21(31)27(4)19(14)29)2315(12)9561011(79)3383210h5723H822H214H3
MFCD07022534
O=c1c2c(c((nH)c2n(c(=O)n1C)C)c1ccc2c(c1)OCO2)c1c(N)n(C)c(=O)n(c1=O)C
ZINC000012427781
ZINC12427781
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