Vitas-M small molecule compound
2-[2-(cyclohex-1-en-1-yl)ethyl]-3a-methyl-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK751327
SMILES O=C1N(CCC2=CCCCC2)C(=O)C2(C1C(C=CC2c1ccccc1)c1ccccc1)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 C29H31NO2 MW 425.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31NO2/c1-29-25(23-15-9-4-10-16-23)18-17-24(22-13-7-3-8-14-22)26(29)27(31)30(28(29)32)20-19-21-11-5-2-6-12-21/h3-4,7-11,13-18,24-26H,2,5-6,12,19-20H2,1H3InChIKey
IRKARXPTWCTTMK-UHFFFAOYSA-NSynonyms
2(2(cyclohex1en1yl)ethyl)3amethyl47diphenyl3a477atetrahydro1Hisoindole13(2H)dione
2(2(CYCLOHEXEN1YL)ETHYL)7AMETHYL47DIPHENYL47DIHYDRO3AHISOINDOLE13DIONE
2(2CYCLOHEX1ENYLETHYL)7AMETHYL47DIPHENYL473A7ATETRAHYDROISOINDOLE13DIONE
CC12C(C=CC(C1C(=O)N(C2=O)CCC3=CCCCC3)C4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC29H31NO2c12925(231594101623)181724(22137381422)26(29)27(31)30(28(29)32)201921115261221h3471113182426H256121920H21H3
MFCD00500275
ZINC000102984523
ZINC000245238286
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