Vitas-M small molecule compound
5-bromo-2'-(3,4-dimethoxyphenyl)-1',10b'-dihydrospiro[indole-3,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2(1H)-one
Catalog ID
STK889275
SMILES COc1cc(ccc1OC)C1=NN2C(C1)c1ccccc1OC12C(=O)Nc2c1cc(Br)cc2
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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 C25H20BrN3O4 MW 506.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20BrN3O4/c1-31-22-10-7-14(11-23(22)32-2)19-13-20-16-5-3-4-6-21(16)33-25(29(20)28-19)17-12-15(26)8-9-18(17)27-24(25)30/h3-12,20H,13H2,1-2H3,(H,27,30)InChIKey
STRYJZHDJLNWCH-UHFFFAOYSA-NSynonyms
5bromo2(34dimethoxyphenyl)110bdihydrospiro(indole35pyrazolo(15c)(13)benzoxazin)2(1H)one
5bromo2(34dimethoxyphenyl)spiro(110bdihydropyrazolo(15c)(13)benzoxazine531Hindole)2one
COC1=C(C=C(C=C1)C2=NN3C(C2)C4=CC=CC=C4OC35C6=C(C=CC(=C6)Br)NC5=O)OC
InChI=1SC25H20BrN3O4c1312210714(1123(22)322)19132016534621(16)3325(29(20)2819)171215(26)8918(17)2724(25)30h31220H13H212H3(H2730)
MFCD18172103
ZINC000040487512
ZINC000226241540
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