Vitas-M small molecule compound

1-{9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1',10b'-dihydro-1H-spiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-1-yl}ethanone

Catalog ID
STL035112
SMILES FC(Oc1ccc(cc1)C1=NN2C(C1)c1cc(Br)ccc1OC12CCN(CC1)C(=O)C)F

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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 C23H22BrF2N3O3 MW 506.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrF2N3O3/c1-14(30)28-10-8-23(9-11-28)29-20(18-12-16(24)4-7-21(18)32-23)13-19(27-29)15-2-5-17(6-3-15)31-22(25)26/h2-7,12,20,22H,8-11,13H2,1H3
InChIKey
VHNIXFNSSYLGBA-UHFFFAOYSA-N
Synonyms
890096-72-7
1(9bromo2(4(difluoromethoxy)phenyl)110bdihydro1Hspiro(piperidine45pyrazolo(15c)(13)benzoxazin)1yl)ethanone
1(9bromo2(4(difluoromethoxy)phenyl)110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54piperidin)1yl)ethanone
1(9BROMO2(4(DIFLUOROMETHOXY)PHENYL)SPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54PIPERIDINE)1YL)ETHANONE
1ACETYL9BROMO2(4(DIFLUOROMETHOXY)PHENYL)110BDIHYDROSPIRO(PIPERIDINE45PYRAZOLO(15C)(13)BENZOXAZINE)
890096727
CC(=O)N1CCC2(CC1)N3C(CC(=N3)C4=CC=C(C=C4)OC(F)F)C5=C(O2)C=CC(=C5)Br
InChI=1SC23H22BrF2N3O3c114(30)2810823(91128)2920(181216(24)4721(18)3223)1319(2729)152517(6315)3122(25)26h27122022H81113H21H3
MFCD18191984
ZINC000009427804
ZINC000013647189

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Available files

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