Vitas-M small molecule compound
9'-bromo-2'-(2,5-dimethylphenyl)-4-phenyl-1',10b'-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK543872
SMILES Brc1ccc2c(c1)C1CC(=NN1C1(O2)CCC(CC1)c1ccccc1)c1cc(C)ccc1C
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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 C29H29BrN2O MW 501.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29BrN2O/c1-19-8-9-20(2)24(16-19)26-18-27-25-17-23(30)10-11-28(25)33-29(32(27)31-26)14-12-22(13-15-29)21-6-4-3-5-7-21/h3-11,16-17,22,27H,12-15,18H2,1-2H3InChIKey
QACLXHKUHUGWAJ-UHFFFAOYSA-NSynonyms
1024438-35-41024438354
9bromo2(25dimethylphenyl)4phenyl110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine51cyclohexane)
9bromo2(25dimethylphenyl)4phenyl110bdihydrospiro(cyclohexane15pyrazolo(15c)(13)benzoxazine)
9BROMO2(25DIMETHYLPHENYL)4PHENYLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE51CYCLOHEXANE)
CC1=CC(=C(C=C1)C)C2=NN3C(C2)C4=C(C=CC(=C4)Br)OC35CCC(CC5)C6=CC=CC=C6
InChI=1SC29H29BrN2Oc1198920(2)24(1619)261827251723(30)101128(25)3329(32(27)3126)141222(131529)216435721h31116172227H121518H212H3
MFCD03298689
ZINC000008837416
ZINC000008837417
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