Vitas-M small molecule compound
2'-(1,3-benzodioxol-5-yl)-1-benzyl-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK558486
SMILES c1ccc(cc1)CN1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1ccc2c(c1)OCO2
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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 C28H27N3O3 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O3/c1-2-6-20(7-3-1)18-30-14-12-28(13-15-30)31-24(22-8-4-5-9-25(22)34-28)17-23(29-31)21-10-11-26-27(16-21)33-19-32-26/h1-11,16,24H,12-15,17-19H2InChIKey
OZOAWEGAMINUIU-UHFFFAOYSA-NSynonyms
488716-43-42(13benzodioxol5yl)1benzyl110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
2(13BENZODIOXOL5YL)1BENZYLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54PIPERIDINE)
2(benzo(d)(13)dioxol5yl)1benzyl110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54piperidine)
488716434
C1CN(CCC12N3C(CC(=N3)C4=CC5=C(C=C4)OCO5)C6=CC=CC=C6O2)CC7=CC=CC=C7
InChI=1SC28H27N3O3c12620(731)1830141228(131530)3124(22845925(22)3428)1723(2931)2110112627(1621)33193226h1111624H12151719H2
MFCD03291030
ZINC000009136406
ZINC000009136413
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