Vitas-M small molecule compound
6-(1,3-benzodioxol-5-ylmethyl)-5-(2-bromophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Catalog ID
STK693292
SMILES Brc1ccccc1c1n(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 C22H18BrN3O4 MW 468.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrN3O4/c1-24-16-11-26(10-13-7-8-17-18(9-13)30-12-29-17)20(14-5-3-4-6-15(14)23)19(16)21(27)25(2)22(24)28/h3-9,11H,10,12H2,1-2H3InChIKey
OENBEWRSVNCCBX-UHFFFAOYSA-NSynonyms
6(13benzodioxol5ylmethyl)5(2bromophenyl)13dimethyl1Hpyrrolo(34d)pyrimidine24(3H6H)dione
6(13benzodioxol5ylmethyl)5(2bromophenyl)13dimethylpyrrolo(34d)pyrimidine24dione
CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=CC=C3Br)CC4=CC5=C(C=C4)OCO5
InChI=1SC22H18BrN3O4c124161126(1013781718(913)30122917)20(14534615(14)23)19(16)21(27)25(2)22(24)28h3911H1012H212H3
MFCD10039389
ZINC000015106269
ZINC15106269
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