Vitas-M small molecule compound
3-(4-bromophenyl)-5-(4-chloro-2-methoxy-5-methylphenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Catalog ID
STK569384
SMILES COc1cc(Cl)c(cc1N1C(=O)C2C(C1=O)C(=NO2)c1ccc(cc1)Br)C
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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 C19H14BrClN2O4 MW 449.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14BrClN2O4/c1-9-7-13(14(26-2)8-12(9)21)23-18(24)15-16(22-27-17(15)19(23)25)10-3-5-11(20)6-4-10/h3-8,15,17H,1-2H3InChIKey
SECGSVQQLYOHTO-UHFFFAOYSA-NSynonyms
(3aR6aS)3(4bromophenyl)5(4chloro2methoxy5methylphenyl)3aHpyrrolo(34d)isoxazole46(5H6aH)dione
3(4BROMOPHENYL)5(4CHLORO2METHOXY5METHYLPHENYL)3A6ADIHYDROPYRROLO(34D)(12)OXAZOLE46DIONE
3(4bromophenyl)5(4chloro2methoxy5methylphenyl)3aHpyrrolo(34d)(12)oxazole46(5H6aH)dione
CC1=CC(=C(C=C1Cl)OC)N2C(=O)C3C(C2=O)ON=C3C4=CC=C(C=C4)Br
COc1cc(Cl)c(cc1N1C(=O)(C@@H)2(C@H)(C1=O)C(=NO2)c1ccc(cc1)Br)C
InChI=1SC19H14BrClN2O4c19713(14(262)812(9)21)2318(24)1516(222717(15)19(23)25)103511(20)6410h381517H12H3
MFCD18157947
ZINC000016011586
ZINC000102557244
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