Vitas-M small molecule compound
9'-bromo-2'-(4-chlorophenyl)-4-methyl-1',10b'-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK740273
SMILES CC1CCC2(CC1)Oc1ccc(cc1C1N2N=C(C1)c1ccc(cc1)Cl)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 C22H22BrClN2O MW 445.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22BrClN2O/c1-14-8-10-22(11-9-14)26-20(18-12-16(23)4-7-21(18)27-22)13-19(25-26)15-2-5-17(24)6-3-15/h2-7,12,14,20H,8-11,13H2,1H3InChIKey
ZCCQDUWQCGXNAB-UHFFFAOYSA-NSynonyms
956778-53-32BROMO9(4CHLOROPHENYL)14METHYLSPIRO(10AHBENZO(E)2PYRAZOLINO(15C)13OXAZINE64CYCLOHEXANE)
956778533
9bromo2(4chlorophenyl)4methyl110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine51cyclohexane)
9bromo2(4chlorophenyl)4methyl110bdihydrospiro(cyclohexane15pyrazolo(15c)(13)benzoxazine)
9BROMO2(4CHLOROPHENYL)4METHYLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE51CYCLOHEXANE)
CC1CCC2(CC1)N3C(CC(=N3)C4=CC=C(C=C4)Cl)C5=C(O2)C=CC(=C5)Br
InChI=1SC22H22BrClN2Oc11481022(11914)2620(181216(23)4721(18)2722)1319(2526)152517(24)6315h27121420H81113H21H3
MFCD03682276
ZINC000009428662
ZINC000009428663
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