Vitas-M small molecule compound
2'-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-phenyl-1',10b'-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK993354
SMILES c1ccc(cc1)C1CCC2(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 C29H28N2O3 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O3/c1-2-6-20(7-3-1)21-12-14-29(15-13-21)31-25(23-8-4-5-9-26(23)34-29)19-24(30-31)22-10-11-27-28(18-22)33-17-16-32-27/h1-11,18,21,25H,12-17,19H2InChIKey
KUJBBXCUFIJENV-UHFFFAOYSA-NSynonyms
956763-93-22(23dihydro14benzodioxin6yl)4phenyl110bdihydrospiro(cyclohexane15pyrazolo(15c)(13)benzoxazine)
2(23DIHYDRO14BENZODIOXIN6YL)4PHENYLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE51CYCLOHEXANE)
2(23dihydrobenzo(b)(14)dioxin6yl)4phenyl110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine51cyclohexane)
956763932
C1CC2(CCC1C3=CC=CC=C3)N4C(CC(=N4)C5=CC6=C(C=C5)OCCO6)C7=CC=CC=C7O2
InChI=1SC29H28N2O3c12620(731)21121429(151321)3125(23845926(23)3429)1924(3031)2210112728(1822)3317163227h111182125H121719H2
MFCD03296887
ZINC000009362739
ZINC000009362740
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