Vitas-M small molecule compound
[9-bromo-2-(thiophen-2-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl](4-methoxyphenyl)methanone
Catalog ID
STL191700
SMILES COc1ccc(cc1)C(=O)C1Oc2ccc(cc2C2N1N=C(C2)c1cccs1)Br
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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 C22H17BrN2O3S MW 469.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrN2O3S/c1-27-15-7-4-13(5-8-15)21(26)22-25-18(12-17(24-25)20-3-2-10-29-20)16-11-14(23)6-9-19(16)28-22/h2-11,18,22H,12H2,1H3InChIKey
XRTWHEZZNKXZQY-UHFFFAOYSA-NSynonyms
(9bromo2(thiophen2yl)110bdihydropyrazolo(15c)(13)benzoxazin5yl)(4methoxyphenyl)methanone
(9BROMO2THIOPHEN2YL510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZIN5YL)(4METHOXYPHENYL)METHANONE
COC1=CC=C(C=C1)C(=O)C2N3C(CC(=N3)C4=CC=CS4)C5=C(O2)C=CC(=C5)Br
InChI=1SC22H17BrN2O3Sc127157413(5815)21(26)222518(1217(2425)2032102920)161114(23)6919(16)2822h2111822H12H21H3
MFCD04119826
ZINC000025783044
ZINC000025783050
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