Vitas-M small molecule compound
9-bromo-2-(4-methylphenyl)-5-[4-(pentyloxy)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STK739898
SMILES CCCCCOc1ccc(cc1)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 C28H29BrN2O2 MW 505.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29BrN2O2/c1-3-4-5-16-32-23-13-10-21(11-14-23)28-31-26(24-17-22(29)12-15-27(24)33-28)18-25(30-31)20-8-6-19(2)7-9-20/h6-15,17,26,28H,3-5,16,18H2,1-2H3InChIKey
YJSFPYVKUWOITK-UHFFFAOYSA-NSynonyms
1(2BROMO9(4METHYLPHENYL)(6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN6YL))4PENTYLOXYBENZENE
9bromo2(4methylphenyl)5(4(pentyloxy)phenyl)110bdihydropyrazolo(15c)(13)benzoxazine
9BROMO2(4METHYLPHENYL)5(4PENTOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
9bromo5(4(pentyloxy)phenyl)2(ptolyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
CCCCCOC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=C(C=C4)C)C5=C(O2)C=CC(=C5)Br
InChI=1SC28H29BrN2O2c1345163223131021(111423)283126(241722(29)121527(24)3328)1825(3031)208619(2)7920h615172628H351618H212H3
MFCD02989453
ZINC000008838120
ZINC000012195522
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