Vitas-M small molecule compound
3-(4-methoxybenzyl)-2-(3-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Catalog ID
STK990967
SMILES COc1ccc(cc1)Cn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1cccc(c1)[N+](=O)[O-]
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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 C25H17N3O6 MW 455.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17N3O6/c1-33-18-11-9-15(10-12-18)14-27-23(16-5-4-6-17(13-16)28(31)32)26-24-21(25(27)30)22(29)19-7-2-3-8-20(19)34-24/h2-13H,14H2,1H3InChIKey
XDZFAUOFBZGGDK-UHFFFAOYSA-NSynonyms
3((4methoxyphenyl)methyl)2(3nitrophenyl)chromeno(23d)pyrimidine45dione
3(4methoxybenzyl)2(3nitrophenyl)4Hchromeno(23d)pyrimidine45(3H)dione
COC1=CC=C(C=C1)CN2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4O3)C5=CC(=CC=C5)(N+)(=O)(O)
COc1ccc(cc1)Cn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1cccc(c1)(N+)(=O)(O)
InChI=1SC25H17N3O6c1331811915(101218)142723(1654617(1316)28(31)32)262421(25(27)30)22(29)19723820(19)3424h213H14H21H3
MFCD07801743
ZINC000008836294
ZINC08836294
ZINC8836294
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