Vitas-M small molecule compound
2,3-dimethoxy-6-[2-(naphthalen-1-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoic acid
Catalog ID
STK539405
SMILES COc1c(OC)ccc(c1C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1cccc2c1cccc2
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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 C29H24N2O5 MW 480.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N2O5/c1-34-25-15-14-21(26(29(32)33)27(25)35-2)28-31-23(20-11-5-6-13-24(20)36-28)16-22(30-31)19-12-7-9-17-8-3-4-10-18(17)19/h3-15,23,28H,16H2,1-2H3,(H,32,33)InChIKey
YNUKXPZBHZYHKC-UHFFFAOYSA-NSynonyms
385416-81-923dimethoxy6(2(naphthalen1yl)110bdihydropyrazolo(15c)(13)benzoxazin5yl)benzoicacid
23dimethoxy6(2(naphthalen1yl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazin5yl)benzoicacid
23DIMETHOXY6(2NAPHTHALEN1YL510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZIN5YL)BENZOICACID
385416819
COC1=C(C(=C(C=C1)C2N3C(CC(=N3)C4=CC=CC5=CC=CC=C54)C6=CC=CC=C6O2)C(=O)O)OC
InChI=1SC29H24N2O5c13425151421(26(29(32)33)27(25)352)283123(2011561324(20)3628)1622(3031)191279178341018(17)19h3152328H16H212H3(H3233)
MFCD03285953
ZINC000009216543
ZINC000013552587
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