Vitas-M small molecule compound
5-(4-butoxyphenyl)-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STK867356
SMILES CCCCOc1ccc(cc1)C1Oc2ccccc2C2N1N=C(C2)c1ccc(cc1)C
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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 C27H28N2O2 MW 412.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O2/c1-3-4-17-30-22-15-13-21(14-16-22)27-29-25(23-7-5-6-8-26(23)31-27)18-24(28-29)20-11-9-19(2)10-12-20/h5-16,25,27H,3-4,17-18H2,1-2H3InChIKey
SPPJASBVBZPPEC-UHFFFAOYSA-NSynonyms
4BUTOXY1(9(4METHYLPHENYL)(6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN6YL))BENZENE
5(4butoxyphenyl)2(4methylphenyl)110bdihydropyrazolo(15c)(13)benzoxazine
5(4BUTOXYPHENYL)2(4METHYLPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
5(4butoxyphenyl)2(ptolyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
CCCCOC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=C(C=C4)C)C5=CC=CC=C5O2
InChI=1SC27H28N2O2c134173022151321(141622)272925(23756826(23)3127)1824(2829)2011919(2)101220h5162527H341718H212H3
MFCD02240074
ZINC000004811623
ZINC000012192246
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