Vitas-M small molecule compound
2'-(1,3-benzodioxol-5-yl)-4-phenyl-1',10b'-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK544018
SMILES c1ccc(cc1)C1CCC2(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 C28H26N2O3 MW 438.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O3/c1-2-6-19(7-3-1)20-12-14-28(15-13-20)30-24(22-8-4-5-9-25(22)33-28)17-23(29-30)21-10-11-26-27(16-21)32-18-31-26/h1-11,16,20,24H,12-15,17-18H2InChIKey
MXKLKHKDQYOCAB-UHFFFAOYSA-NSynonyms
956372-13-72(13benzodioxol5yl)4phenyl110bdihydrospiro(cyclohexane15pyrazolo(15c)(13)benzoxazine)
2(13BENZODIOXOL5YL)4PHENYLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE51CYCLOHEXANE)
2(benzo(d)(13)dioxol5yl)4phenyl110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine51cyclohexane)
956372137
C1CC2(CCC1C3=CC=CC=C3)N4C(CC(=N4)C5=CC6=C(C=C5)OCO6)C7=CC=CC=C7O2
InChI=1SC28H26N2O3c12619(731)20121428(151320)3024(22845925(22)3328)1723(2930)2110112627(1621)32183126h111162024H12151718H2
MFCD03297149
ZINC000009234758
ZINC000009234759
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