Vitas-M small molecule compound
9-bromo-2-(furan-2-yl)-7-methoxy-5-(4-nitrophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STL022290
SMILES COc1cc(Br)cc2c1OC(c1ccc(cc1)[N+](=O)[O-])N1C2CC(=N1)c1ccco1
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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 C21H16BrN3O5 MW 470.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrN3O5/c1-28-19-10-13(22)9-15-17-11-16(18-3-2-8-29-18)23-24(17)21(30-20(15)19)12-4-6-14(7-5-12)25(26)27/h2-10,17,21H,11H2,1H3InChIKey
GQXFCZYDPCPUCS-UHFFFAOYSA-NSynonyms
2BROMO9(2FURYL)4METHOXY6(4NITROPHENYL)6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZINE
9bromo2(furan2yl)7methoxy5(4nitrophenyl)110bdihydropyrazolo(15c)(13)benzoxazine
9bromo2(furan2yl)7methoxy5(4nitrophenyl)510bdihydro1Hpyrazolo(15c)(13)benzoxazine
COC1=C2C(=CC(=C1)Br)C3CC(=NN3C(O2)C4=CC=C(C=C4)(N+)(=O)(O))C5=CC=CO5
COc1cc(Br)cc2c1OC(c1ccc(cc1)(N+)(=O)(O))N1C2CC(=N1)c1ccco1
InChI=1SC21H16BrN3O5c128191013(22)915171116(183282918)2324(17)21(3020(15)19)124614(7512)25(26)27h2101721H11H21H3
MFCD06640443
ZINC000000934708
ZINC000226415808
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