Vitas-M small molecule compound
2-(3-bromophenyl)-4-(2-chlorophenyl)-6,7-dimethoxy-4H-3,1-benzoxazine
Catalog ID
STK344438
SMILES COc1cc2c(cc1OC)N=C(OC2c1ccccc1Cl)c1cccc(c1)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 C22H17BrClNO3 MW 458.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrClNO3/c1-26-19-11-16-18(12-20(19)27-2)25-22(13-6-5-7-14(23)10-13)28-21(16)15-8-3-4-9-17(15)24/h3-12,21H,1-2H3InChIKey
LUZYEMRWTAHHCM-UHFFFAOYSA-NSynonyms
2(3bromophenyl)4(2chlorophenyl)67dimethoxy4H31benzoxazine
COC1=C(C=C2C(=C1)C(OC(=N2)C3=CC(=CC=C3)Br)C4=CC=CC=C4Cl)OC
InChI=1SC22H17BrClNO3c12619111618(1220(19)272)2522(1365714(23)1013)2821(16)15834917(15)24h31221H12H3
MFCD09965023
ZINC000012854910
ZINC000012854916
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