Vitas-M small molecule compound
1-benzyl-2'-(2,3-dihydro-1,4-benzodioxin-6-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK993347
SMILES c1ccc(cc1)CN1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1ccc2c(c1)OCCO2
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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 C29H29N3O3 MW 467.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O3/c1-2-6-21(7-3-1)20-31-14-12-29(13-15-31)32-25(23-8-4-5-9-26(23)35-29)19-24(30-32)22-10-11-27-28(18-22)34-17-16-33-27/h1-11,18,25H,12-17,19-20H2InChIKey
JOUIYVNIHLAGFW-UHFFFAOYSA-NSynonyms
500196-41-81benzyl2(23dihydro14benzodioxin6yl)110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
1BENZYL2(23DIHYDRO14BENZODIOXIN6YL)SPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54PIPERIDINE)
1benzyl2(23dihydrobenzo(b)(14)dioxin6yl)110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54piperidine)
500196418
C1CN(CCC12N3C(CC(=N3)C4=CC5=C(C=C4)OCCO5)C6=CC=CC=C6O2)CC7=CC=CC=C7
InChI=1SC29H29N3O3c12621(731)2031141229(131531)3225(23845926(23)3529)1924(3032)2210112728(1822)3417163327h1111825H12171920H2
MFCD03304992
ZINC000008838223
ZINC000009359480
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