Vitas-M small molecule compound
9'-bromo-2'-(3,4-dimethoxyphenyl)-2,2-dimethyl-1',2,3,5,6,10b'-hexahydrospiro[pyran-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK993325
SMILES COc1cc(ccc1OC)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 C24H27BrN2O4 MW 487.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27BrN2O4/c1-23(2)14-24(9-10-30-23)27-19(17-12-16(25)6-8-20(17)31-24)13-18(26-27)15-5-7-21(28-3)22(11-15)29-4/h5-8,11-12,19H,9-10,13-14H2,1-4H3InChIKey
LOALXCOTIUEAPI-UHFFFAOYSA-NSynonyms
672889-33-7672889337
9bromo2(34dimethoxyphenyl)22dimethyl1235610bhexahydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54pyran)
9bromo2(34dimethoxyphenyl)22dimethyl1235610bhexahydrospiro(pyran45pyrazolo(15c)(13)benzoxazine)
9BROMO2(34DIMETHOXYPHENYL)22DIMETHYLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54OXANE)
CC1(CC2(CCO1)N3C(CC(=N3)C4=CC(=C(C=C4)OC)OC)C5=C(O2)C=CC(=C5)Br)C
InChI=1SC24H27BrN2O4c123(2)1424(9103023)2719(171216(25)6820(17)3124)1318(2627)155721(283)22(1115)294h58111219H9101314H214H3
MFCD03267113
ZINC000009033216
ZINC000100748103
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