Vitas-M small molecule compound
5-methyl-2-(propan-2-yl)cyclohexyl 2-(4-ethoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Catalog ID
STK268578
SMILES CCOc1ccc(cc1)N1C(=O)c2c(C1=O)ccc(c2)C(=O)OC1CC(C)CCC1C(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 C27H31NO5 MW 449.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31NO5/c1-5-32-20-10-8-19(9-11-20)28-25(29)22-13-7-18(15-23(22)26(28)30)27(31)33-24-14-17(4)6-12-21(24)16(2)3/h7-11,13,15-17,21,24H,5-6,12,14H2,1-4H3InChIKey
COHHINVPZAHRJL-UHFFFAOYSA-NSynonyms
(5METHYL2PROPAN2YLCYCLOHEXYL)2(4ETHOXYPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
2ISOPROPYL5METHYLCYCLOHEXYL2(4ETHOXYPHENYL)13DIOXO5ISOINDOLINECARBOXYLATE
5methyl2(propan2yl)cyclohexyl2(4ethoxyphenyl)13dioxo23dihydro1Hisoindole5carboxylate
CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC4CC(CCC4C(C)C)C
InChI=1SC27H31NO5c15322010819(91120)2825(29)2213718(1523(22)26(28)30)27(31)33241417(4)61221(24)16(2)3h7111315172124H561214H214H3
MFCD01360174
ZINC000004174584
ZINC000239030913
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