Vitas-M small molecule compound
5-methyl-2-(propan-2-yl)cyclohexyl 1,3-dioxo-2-(4-phenoxyphenyl)-2,3-dihydro-1H-isoindole-5-carboxylate
Catalog ID
STK252863
SMILES CC1CCC(C(C1)OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)Oc1ccccc1)C(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 C31H31NO5 MW 497.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31NO5/c1-19(2)25-15-9-20(3)17-28(25)37-31(35)21-10-16-26-27(18-21)30(34)32(29(26)33)22-11-13-24(14-12-22)36-23-7-5-4-6-8-23/h4-8,10-14,16,18-20,25,28H,9,15,17H2,1-3H3InChIKey
RTGSBQTXXZFRDD-UHFFFAOYSA-NSynonyms
(5METHYL2PROPAN2YLCYCLOHEXYL)13DIOXO2(4PHENOXYPHENYL)ISOINDOLE5CARBOXYLATE
5METHYL2(METHYLETHYL)CYCLOHEXYL13DIOXO2(4PHENOXYPHENYL)BENZO(C)AZOLIDINE5CARBOXYLATE
5METHYL2(PROPAN2YL)CYCLOHEXYL13DIOXO2(4PHENOXYPHENYL)23DIHYDRO1HISOINDOLE5CARBOXYLATE
CC1CCC(C(C1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)OC5=CC=CC=C5)C(C)C
InChI=1SC31H31NO5c119(2)2515920(3)1728(25)3731(35)2110162627(1821)30(34)32(29(26)33)22111324(141222)36237546823h4810141618202528H91517H213H3
MFCD01825483
ZINC000008843227
ZINC000012319124
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