Vitas-M small molecule compound
7-bromo-3-(2-methoxyethyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Catalog ID
STK714959
SMILES COCCn1c(nc2c(c1=O)c(=O)c1c(o2)ccc(c1)Br)c1ccc(cc1)[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 C20H14BrN3O6 MW 472.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14BrN3O6/c1-29-9-8-23-18(11-2-5-13(6-3-11)24(27)28)22-19-16(20(23)26)17(25)14-10-12(21)4-7-15(14)30-19/h2-7,10H,8-9H2,1H3InChIKey
YIXZGNHXEGSWIY-UHFFFAOYSA-NSynonyms
879441-61-97bromo3(2methoxyethyl)2(4nitrophenyl)3Hchromeno(23d)pyrimidine45dione
7bromo3(2methoxyethyl)2(4nitrophenyl)4Hchromeno(23d)pyrimidine45(3H)dione
7BROMO3(2METHOXYETHYL)2(4NITROPHENYL)CHROMENO(23D)PYRIMIDINE45DIONE
879441619
COCCN1C(=NC2=C(C1=O)C(=O)C3=C(O2)C=CC(=C3)Br)C4=CC=C(C=C4)(N+)(=O)(O)
COCCn1c(nc2c(c1=O)c(=O)c1c(o2)ccc(c1)Br)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H14BrN3O6c129982318(112513(6311)24(27)28)221916(20(23)26)17(25)141012(21)4715(14)3019h2710H89H21H3
MFCD06610069
ZINC000002347571
ZINC02347571
ZINC2347571
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