Vitas-M small molecule compound
2'-(3,4-dichlorophenyl)-2,2-dimethyl-1',2,3,5,6,10b'-hexahydrospiro[pyran-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STL239862
SMILES Clc1ccc(cc1Cl)C1=NN2C(C1)c1ccccc1OC12CCOC(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 C22H22Cl2N2O2 MW 417.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22Cl2N2O2/c1-21(2)13-22(9-10-27-21)26-19(15-5-3-4-6-20(15)28-22)12-18(25-26)14-7-8-16(23)17(24)11-14/h3-8,11,19H,9-10,12-13H2,1-2H3InChIKey
NXBFSSGECZATPP-UHFFFAOYSA-NSynonyms
500146-18-92(34dichlorophenyl)22dimethyl1235610bhexahydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54pyran)
2(34dichlorophenyl)22dimethyl1235610bhexahydrospiro(pyran45pyrazolo(15c)(13)benzoxazine)
2(34DICHLOROPHENYL)22DIMETHYLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54OXANE)
500146189
CC1(CC2(CCO1)N3C(CC(=N3)C4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5O2)C
InChI=1SC22H22Cl2N2O2c121(2)1322(9102721)2619(15534620(15)2822)1218(2526)147816(23)17(24)1114h381119H9101213H212H3
MFCD03304549
ZINC000004956822
ZINC000013617924
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