Vitas-M small molecule compound
5-(3-bromo-4-methoxyphenyl)-2-(thiophen-2-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STL005619
SMILES COc1ccc(cc1Br)C1Oc2ccccc2C2N1N=C(C2)c1cccs1
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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 C21H17BrN2O2S MW 441.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrN2O2S/c1-25-19-9-8-13(11-15(19)22)21-24-17(14-5-2-3-6-18(14)26-21)12-16(23-24)20-7-4-10-27-20/h2-11,17,21H,12H2,1H3InChIKey
FVAQXQHMGOSKMN-UHFFFAOYSA-NSynonyms
847368-38-15(3bromo4methoxyphenyl)2(thiophen2yl)110bdihydropyrazolo(15c)(13)benzoxazine
5(3bromo4methoxyphenyl)2(thiophen2yl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
5(3BROMO4METHOXYPHENYL)2THIOPHEN2YL510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
847368381
COC1=C(C=C(C=C1)C2N3C(CC(=N3)C4=CC=CS4)C5=CC=CC=C5O2)Br
InChI=1SC21H17BrN2O2Sc125199813(1115(19)22)212417(14523618(14)2621)1216(2324)2074102720h2111721H12H21H3
MFCD04180904
ZINC000009158904
ZINC000013776747
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