Vitas-M small molecule compound
4-[3-(3-bromo-4-methoxyphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzonitrile
Catalog ID
STL348706
SMILES N#Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(c(c1)Br)OC
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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 C25H18BrN3O4 MW 504.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18BrN3O4/c1-32-20-12-9-16(13-19(20)26)22-21-23(33-29(22)18-5-3-2-4-6-18)25(31)28(24(21)30)17-10-7-15(14-27)8-11-17/h2-13,21-23H,1H3InChIKey
VCVCBLFBVKPWFA-UHFFFAOYSA-NSynonyms
1023831-49-31023831493
4(3(3BROMO4METHOXYPHENYL)46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL5YL)BENZONITRILE
4(3(3bromo4methoxyphenyl)46dioxo2phenylhexahydro5Hpyrrolo(34d)(12)oxazol5yl)benzonitrile
4(3(3bromo4methoxyphenyl)46dioxo2phenyltetrahydro2Hpyrrolo(34d)isoxazol5(3H)yl)benzonitrile
COC1=C(C=C(C=C1)C2C3C(C(=O)N(C3=O)C4=CC=C(C=C4)C#N)ON2C5=CC=CC=C5)Br
InChI=1SC25H18BrN3O4c1322012916(1319(20)26)222123(3329(22)185324618)25(31)28(24(21)30)1710715(1427)81117h2132123H1H3
MFCD05691295
ZINC000017991389
ZINC000226897292
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