Vitas-M small molecule compound
4,7-diethyl-2-(4-methylphenyl)-5,6-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Catalog ID
STK710078
SMILES CCC12C3C(=O)N(C(=O)C3C(C2=O)(C(=C1c1ccccc1)c1ccccc1)CC)c1ccc(cc1)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 C32H29NO3 MW 475.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29NO3/c1-4-31-24(21-12-8-6-9-13-21)25(22-14-10-7-11-15-22)32(5-2,30(31)36)27-26(31)28(34)33(29(27)35)23-18-16-20(3)17-19-23/h6-19,26-27H,4-5H2,1-3H3InChIKey
VCYUQBBWVZLXJB-UHFFFAOYSA-NSynonyms
(3aR4R7S7aS)47diethyl56diphenyl2(ptolyl)3a477atetrahydro1H47methanoisoindole138(2H)trione
47diethyl2(4methylphenyl)56diphenyl3a477atetrahydro1H47methanoisoindole138(2H)trione
CCC12C3C(=O)N(C(=O)(C@H)3C(C2=O)(C(=C1c1ccccc1)c1ccccc1)CC)c1ccc(cc1)C
CCC12C3C(C(=O)N(C3=O)C4=CC=C(C=C4)C)C(C1=O)(C(=C2C5=CC=CC=C5)C6=CC=CC=C6)CC
InChI=1SC32H29NO3c143124(21128691321)25(2214107111522)32(5230(31)36)2726(31)28(34)33(29(27)35)23181620(3)171923h6192627H45H213H3
MFCD00304906
ZINC000001091566
ZINC000105747369
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