Vitas-M small molecule compound
6-(1,3-benzodioxol-5-ylmethyl)-5-(4-methoxyphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Catalog ID
STK694547
SMILES COc1ccc(cc1)c1n(Cc2ccc3c(c2)OCO3)cc2c1c(=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 C23H21N3O5 MW 419.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O5/c1-24-17-12-26(11-14-4-9-18-19(10-14)31-13-30-18)21(15-5-7-16(29-3)8-6-15)20(17)22(27)25(2)23(24)28/h4-10,12H,11,13H2,1-3H3InChIKey
DHBVKJVBTAFKHP-UHFFFAOYSA-NSynonyms
6(13benzodioxol5ylmethyl)5(4methoxyphenyl)13dimethyl1Hpyrrolo(34d)pyrimidine24(3H6H)dione
6(13benzodioxol5ylmethyl)5(4methoxyphenyl)13dimethylpyrrolo(34d)pyrimidine24dione
CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=C(C=C3)OC)CC4=CC5=C(C=C4)OCO5
InChI=1SC23H21N3O5c124171226(1114491819(1014)31133018)21(155716(293)8615)20(17)22(27)25(2)23(24)28h41012H1113H213H3
MFCD12034721
ZINC000035324834
ZINC35324834
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