Vitas-M small molecule compound
2-bromo-4-[9-bromo-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-6-methoxyphenyl acetate
Catalog ID
STK740296
SMILES COc1cc(cc(c1OC(=O)C)Br)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc(cc1)C)Br
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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 C26H22Br2N2O4 MW 586.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22Br2N2O4/c1-14-4-6-16(7-5-14)21-13-22-19-12-18(27)8-9-23(19)34-26(30(22)29-21)17-10-20(28)25(33-15(2)31)24(11-17)32-3/h4-12,22,26H,13H2,1-3H3InChIKey
TWQQNURORMOCSF-UHFFFAOYSA-NSynonyms
(2BROMO4(9BROMO2(4METHYLPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZIN5YL)6METHOXYPHENYL)ACETATE
2BROMO4(2BROMO9(4METHYLPHENYL)(6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN6YL))6METHOXYPHENYLACETATE
2bromo4(9bromo2(4methylphenyl)110bdihydropyrazolo(15c)(13)benzoxazin5yl)6methoxyphenylacetate
2bromo4(9bromo2(ptolyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazin5yl)6methoxyphenylacetate
CC1=CC=C(C=C1)C2=NN3C(C2)C4=C(C=CC(=C4)Br)OC3C5=CC(=C(C(=C5)Br)OC(=O)C)OC
InChI=1SC26H22Br2N2O4c1144616(7514)211322191218(27)8923(19)3426(30(22)2921)171020(28)25(3315(2)31)24(1117)323h4122226H13H213H3
MFCD04009843
ZINC000098000025
ZINC000102973569
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