Vitas-M small molecule compound
2-bromo-4-[9-bromo-2-(4-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-6-methoxyphenyl 4-methylbenzoate
Catalog ID
STL147535
SMILES COc1ccc(cc1)C1=NN2C(C1)c1cc(Br)ccc1OC2c1cc(Br)c(c(c1)OC)OC(=O)c1ccc(cc1)C
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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 C32H26Br2N2O5 MW 678.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H26Br2N2O5/c1-18-4-6-20(7-5-18)32(37)41-30-25(34)14-21(15-29(30)39-3)31-36-27(24-16-22(33)10-13-28(24)40-31)17-26(35-36)19-8-11-23(38-2)12-9-19/h4-16,27,31H,17H2,1-3H3InChIKey
GEKMUXXJMDIFSQ-UHFFFAOYSA-NSynonyms
(2BROMO4(9BROMO2(4METHOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZIN5YL)6METHOXYPHENYL)4METHYLBENZOATE
2bromo4(9bromo2(4methoxyphenyl)110bdihydropyrazolo(15c)(13)benzoxazin5yl)6methoxyphenyl4methylbenzoate
2bromo4(9bromo2(4methoxyphenyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazin5yl)6methoxyphenyl4methylbenzoate
CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2Br)C3N4C(CC(=N4)C5=CC=C(C=C5)OC)C6=C(O3)C=CC(=C6)Br)OC
InChI=1SC32H26Br2N2O5c1184620(7518)32(37)413025(34)1421(1529(30)393)313627(241622(33)101328(24)4031)1726(3536)1981123(382)12919h4162731H17H213H3
MFCD04073237
ZINC000150390314
ZINC000245245700
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