Vitas-M small molecule compound
methyl [8-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]acetate
Catalog ID
STK852827
SMILES COC(=O)Cn1c(CN2CCc3c(C2)cccc3)nc2c1c(=O)n(c(=O)n2C)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/c1-22-18-17(19(27)23(2)20(22)28)25(12-16(26)29-3)15(21-18)11-24-9-8-13-6-4-5-7-14(13)10-24/h4-7H,8-12H2,1-3H3InChIKey
POERGFONJBBQSG-UHFFFAOYSA-NSynonyms
851940-51-7851940517
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCC4=CC=CC=C4C3)CC(=O)OC
InChI=1SC20H23N5O4c1221817(19(27)23(2)20(22)28)25(1216(26)293)15(2118)11249813645714(13)1024h47H812H213H3
methyl(8(34dihydroisoquinolin2(1H)ylmethyl)13dimethyl26dioxo1236tetrahydro7Hpurin7yl)acetate
METHYL2(8((34DIHYDROISOQUINOLIN2(1H)YL)METHYL)13DIMETHYL26DIOXO23DIHYDRO1HPURIN7(6H)YL)ACETATE
METHYL2(8(34DIHYDRO1HISOQUINOLIN2YLMETHYL)13DIMETHYL26DIOXOPURIN7YL)ACETATE
MFCD04466525
ZINC000012532011
ZINC12532011
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