Vitas-M small molecule compound
9'-bromo-2'-(2,4-dichlorophenyl)-2,2-dimethyl-1',2,3,5,6,10b'-hexahydrospiro[pyran-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK543389
SMILES Clc1ccc(c(c1)Cl)C1=NN2C(C1)c1cc(Br)ccc1OC12CCOC(C1)(C)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 C22H21BrCl2N2O2 MW 496.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrCl2N2O2/c1-21(2)12-22(7-8-28-21)27-19(16-9-13(23)3-6-20(16)29-22)11-18(26-27)15-5-4-14(24)10-17(15)25/h3-6,9-10,19H,7-8,11-12H2,1-2H3InChIKey
YRBZIXDRBPZTTP-UHFFFAOYSA-NSynonyms
497077-32-4497077324
9bromo2(24dichlorophenyl)22dimethyl1235610bhexahydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54pyran)
9bromo2(24dichlorophenyl)22dimethyl1235610bhexahydrospiro(pyran45pyrazolo(15c)(13)benzoxazine)
9BROMO2(24DICHLOROPHENYL)22DIMETHYLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54OXANE)
CC1(CC2(CCO1)N3C(CC(=N3)C4=C(C=C(C=C4)Cl)Cl)C5=C(O2)C=CC(=C5)Br)C
InChI=1SC22H21BrCl2N2O2c121(2)1222(782821)2719(16913(23)3620(16)2922)1118(2627)155414(24)1017(15)25h3691019H781112H212H3
MFCD03299291
ZINC000009008001
ZINC000013596851
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