Vitas-M small molecule compound
2-bromo-4-(9-chloro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)-6-methoxyphenyl 4-methylbenzoate
Catalog ID
STK559260
SMILES COc1cc(cc(c1OC(=O)c1ccc(cc1)C)Br)C1Oc2ccc(cc2C2N1N=C(C2)c1ccccc1)Cl
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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 C31H24BrClN2O4 MW 603.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24BrClN2O4/c1-18-8-10-20(11-9-18)31(36)39-29-24(32)14-21(15-28(29)37-2)30-35-26(23-16-22(33)12-13-27(23)38-30)17-25(34-35)19-6-4-3-5-7-19/h3-16,26,30H,17H2,1-2H3InChIKey
NXDOZBYVGXQFGC-UHFFFAOYSA-NSynonyms
674329-08-9(2BROMO4(9CHLORO2PHENYL510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZIN5YL)6METHOXYPHENYL)4METHYLBENZOATE
2bromo4(9chloro2phenyl110bdihydropyrazolo(15c)(13)benzoxazin5yl)6methoxyphenyl4methylbenzoate
2bromo4(9chloro2phenyl510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazin5yl)6methoxyphenyl4methylbenzoate
674329089
CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2Br)C3N4C(CC(=N4)C5=CC=CC=C5)C6=C(O3)C=CC(=C6)Cl)OC
InChI=1SC31H24BrClN2O4c11881020(11918)31(36)392924(32)1421(1528(29)372)303526(231622(33)121327(23)3830)1725(3435)196435719h3162630H17H212H3
MFCD04081896
ZINC000101674075
ZINC000105791766
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