Vitas-M small molecule compound
9-chloro-2-(naphthalen-2-yl)-5-propyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STL191800
SMILES CCCC1Oc2ccc(cc2C2N1N=C(C2)c1ccc2c(c1)cccc2)Cl
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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 C23H21ClN2O MW 376.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN2O/c1-2-5-23-26-21(19-13-18(24)10-11-22(19)27-23)14-20(25-26)17-9-8-15-6-3-4-7-16(15)12-17/h3-4,6-13,21,23H,2,5,14H2,1H3InChIKey
HRKLSAPQMTUJJO-UHFFFAOYSA-NSynonyms
9chloro2(naphthalen2yl)5propyl110bdihydropyrazolo(15c)(13)benzoxazine
9chloro2naphthalen2yl5propyl510bdihydro1Hpyrazolo(15c)(13)benzoxazine
CCCC1N2C(CC(=N2)C3=CC4=CC=CC=C4C=C3)C5=C(O1)C=CC(=C5)Cl
InChI=1SC23H21ClN2Oc125232621(191318(24)101122(19)2723)1420(2526)179815634716(15)1217h346132123H2514H21H3
MFCD22390436
ZINC000048524596
ZINC000106937219
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