Vitas-M small molecule compound
2-(3-methoxyphenyl)-N-(6-methylheptan-2-yl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Catalog ID
STL058335
SMILES COc1cccc(c1)N1CC23C(C1=O)C(C(O3)C=C2)C(=O)NC(CCCC(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 C24H32N2O4 MW 412.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H32N2O4/c1-15(2)7-5-8-16(3)25-22(27)20-19-11-12-24(30-19)14-26(23(28)21(20)24)17-9-6-10-18(13-17)29-4/h6,9-13,15-16,19-21H,5,7-8,14H2,1-4H3,(H,25,27)InChIKey
ZYQVPVZYFQKFEK-UHFFFAOYSA-NSynonyms
1008577-78-3(3aS6R)2(3methoxyphenyl)N(6methylheptan2yl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
1008577783
2(3methoxyphenyl)N(6methylheptan2yl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
CC(C)CCCC(C)NC(=O)C1C2C=CC3(C1C(=O)N(C3)C4=CC(=CC=C4)OC)O2
COc1cccc(c1)N1C(C@)23(C@@H)(C1=O)(C@@H)((C@H)(O3)C=C2)C(=O)N(C@@H)(CCCC(C)C)C
InChI=1SC24H32N2O4c115(2)75816(3)2522(27)2019111224(3019)1426(23(28)21(20)24)17961018(1317)294h691315161921H57814H214H3(H2527)
MFCD08286895
ZINC000006670062
ZINC000013606831
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