Vitas-M small molecule compound
2-(4-bromophenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STL025564
SMILES O=C1C2CC(=C(CC2C(=O)N1c1ccc(cc1)Br)C)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 C16H16BrNO2 MW 334.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16BrNO2/c1-9-7-13-14(8-10(9)2)16(20)18(15(13)19)12-5-3-11(17)4-6-12/h3-6,13-14H,7-8H2,1-2H3InChIKey
IIQPYIRWPMQXIG-UHFFFAOYSA-NSynonyms
2(4bromophenyl)56dimethyl3a477atetrahydro1Hisoindole13(2H)dione
2(4BROMOPHENYL)56DIMETHYL3A477ATETRAHYDROISOINDOLE13DIONE
2(4BROMOPHENYL)56DIMETHYL473A7ATETRAHYDROISOINDOLE13DIONE
CC1=C(CC2C(C1)C(=O)N(C2=O)C3=CC=C(C=C3)Br)C
InChI=1SC16H16BrNO2c1971314(810(9)2)16(20)18(15(13)19)125311(17)4612h361314H78H212H3
MFCD01164863
ZINC000015684739
ZINC000100702587
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