Vitas-M small molecule compound
1-hydroxy-4-methyl-9-[(E)-2-phenylethenyl]-9,10-dihydropyrimido[4,5-c]isoquinoline-3,7(4H,8H)-dione
Catalog ID
STK653792
SMILES O=C1CC(/C=C/c2ccccc2)Cc2c1cnc1c2c(O)nc(=O)n1C
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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 C20H17N3O3 MW 347.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O3/c1-23-18-17(19(25)22-20(23)26)14-9-13(10-16(24)15(14)11-21-18)8-7-12-5-3-2-4-6-12/h2-8,11,13H,9-10H2,1H3,(H,22,25,26)/b8-7+InChIKey
NWOGOUXBBMHBBB-BQYQJAHWSA-NSynonyms
1030480-46-61030480466
1hydroxy4methyl9((E)2phenylethenyl)910dihydropyrimido(45c)isoquinoline37(4H8H)dione
4methyl9((E)2phenylethenyl)910dihydro8Hpyrimido(45c)isoquinoline137trione
CN1C2=NC=C3C(=C2C(=O)NC1=O)CC(CC3=O)C=CC4=CC=CC=C4
InChI=1SC20H17N3O3c1231817(19(25)2220(23)26)14913(1016(24)15(14)112118)87125324612h281113H910H21H3(H222526)b87+
MFCD18166816
O=C1CC(C=Cc2ccccc2)Cc2c1cnc1c2c(O)nc(=O)n1C
ZINC000019962292
ZINC000019962294
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