Vitas-M small molecule compound

2-{4-[2-(heptylamino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-4-oxobutyl}-1H-isoindole-1,3(2H)-dione

Catalog ID
STK683302
SMILES CCCCCCCNC1=C(C(=O)CCCN2C(=O)c3c(C2=O)cccc3)C(=O)CC(C1)(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 C27H36N2O4 MW 452.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H36N2O4/c1-4-5-6-7-10-15-28-21-17-27(2,3)18-23(31)24(21)22(30)14-11-16-29-25(32)19-12-8-9-13-20(19)26(29)33/h8-9,12-13,28H,4-7,10-11,14-18H2,1-3H3
InChIKey
VTDBARGMHCZZRT-UHFFFAOYSA-N
Synonyms

2(4(2(heptylamino)44dimethyl6oxocyclohex1en1yl)4oxobutyl)1Hisoindole13(2H)dione
2(4(2(HEPTYLAMINO)44DIMETHYL6OXOCYCLOHEXEN1YL)4OXOBUTYL)ISOINDOLE13DIONE
CCCCCCCNC1=C(C(=O)CC(C1)(C)C)C(=O)CCCN2C(=O)C3=CC=CC=C3C2=O
InChI=1SC27H36N2O4c14567101528211727(23)1823(31)24(21)22(30)1411162925(32)1912891320(19)26(29)33h89121328H4710111418H213H3
MFCD05257314
ZINC000100156972
ZINC100156972

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Available files

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