Vitas-M small molecule compound
6-[2-(5-bromothiophen-2-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid
Catalog ID
STK538897
SMILES COc1ccc(c(c1OC)C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccc(s1)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 C23H19BrN2O5S MW 515.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19BrN2O5S/c1-29-17-8-7-13(20(23(27)28)21(17)30-2)22-26-15(12-5-3-4-6-16(12)31-22)11-14(25-26)18-9-10-19(24)32-18/h3-10,15,22H,11H2,1-2H3,(H,27,28)InChIKey
WFIIVQXYEPEZJM-UHFFFAOYSA-NSynonyms
384374-24-7384374247
6(2(5bromothiophen2yl)110bdihydropyrazolo(15c)(13)benzoxazin5yl)23dimethoxybenzoicacid
6(2(5bromothiophen2yl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazin5yl)23dimethoxybenzoicacid
6(2(5BROMOTHIOPHEN2YL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZIN5YL)23DIMETHOXYBENZOICACID
COC1=C(C(=C(C=C1)C2N3C(CC(=N3)C4=CC=C(S4)Br)C5=CC=CC=C5O2)C(=O)O)OC
InChI=1SC23H19BrN2O5Sc129178713(20(23(27)28)21(17)302)222615(12534616(12)3122)1114(2526)1891019(24)3218h3101522H11H212H3(H2728)
MFCD03284945
ZINC000009216289
ZINC000013552115
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