Vitas-M small molecule compound
methyl 4-[7,9-dibromo-2-(thiophen-2-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate
Catalog ID
STK740221
SMILES COC(=O)c1ccc(cc1)C1Oc2c(Br)cc(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 C22H16Br2N2O3S MW 548.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16Br2N2O3S/c1-28-22(27)13-6-4-12(5-7-13)21-26-18(11-17(25-26)19-3-2-8-30-19)15-9-14(23)10-16(24)20(15)29-21/h2-10,18,21H,11H2,1H3InChIKey
KLGUHLAFTAUWPE-UHFFFAOYSA-NSynonyms
672269-11-3672269113
COC(=O)C1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=CS4)C5=CC(=CC(=C5O2)Br)Br
InChI=1SC22H16Br2N2O3Sc12822(27)136412(5713)212618(1117(2526)193283019)15914(23)1016(24)20(15)2921h2101821H11H21H3
METHYL4(24DIBROMO9(2THIENYL)6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN6YL)BENZOATE
methyl4(79dibromo2(thiophen2yl)110bdihydropyrazolo(15c)(13)benzoxazin5yl)benzoate
methyl4(79dibromo2(thiophen2yl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazin5yl)benzoate
METHYL4(79DIBROMO2THIOPHEN2YL510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZIN5YL)BENZOATE
MFCD03683282
ZINC000097952152
ZINC000102713288
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