Vitas-M small molecule compound

9'-bromo-1-(methylsulfonyl)-2'-(pyridin-4-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]

Catalog ID
STK993430
SMILES Brc1ccc2c(c1)C1CC(=NN1C1(O2)CCN(CC1)S(=O)(=O)C)c1ccncc1

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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 C20H21BrN4O3S MW 477.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN4O3S/c1-29(26,27)24-10-6-20(7-11-24)25-18(16-12-15(21)2-3-19(16)28-20)13-17(23-25)14-4-8-22-9-5-14/h2-5,8-9,12,18H,6-7,10-11,13H2,1H3
InChIKey
NGNFHADMKSEEGI-UHFFFAOYSA-N
Synonyms
848986-29-8
848986298
9bromo1(methylsulfonyl)2(pyridin4yl)110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54piperidine)
9bromo1(methylsulfonyl)2(pyridin4yl)110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
9BROMO1METHYLSULFONYL2PYRIDIN4YLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54PIPERIDINE)
CS(=O)(=O)N1CCC2(CC1)N3C(CC(=N3)C4=CC=NC=C4)C5=C(O2)C=CC(=C5)Br
InChI=1SC20H21BrN4O3Sc129(2627)2410620(71124)2518(161215(21)2319(16)2820)1317(2325)1448229514h25891218H67101113H21H3
MFCD05678459
ZINC000009233274
ZINC000009233277

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Available files

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