Vitas-M small molecule compound
N-(2,2-dimethoxyethyl)-2-(4-methoxyphenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Catalog ID
STL236828
SMILES COC(CNC(=O)C1C2C=CC3(C1C(=O)N(C3)c1ccc(cc1)OC)O2)OC
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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 C20H24N2O6 MW 388.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O6/c1-25-13-6-4-12(5-7-13)22-11-20-9-8-14(28-20)16(17(20)19(22)24)18(23)21-10-15(26-2)27-3/h4-9,14-17H,10-11H2,1-3H3,(H,21,23)InChIKey
OFHUHVDPVRUHFV-UHFFFAOYSA-NSynonyms
(3aS6R7aR)N(22dimethoxyethyl)2(4methoxyphenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
COC(CNC(=O)(C@@H)1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)c1ccc(cc1)OC)O2)OC
COC1=CC=C(C=C1)N2CC34C=CC(O3)C(C4C2=O)C(=O)NCC(OC)OC
InChI=1SC20H24N2O6c125136412(5713)2211209814(2820)16(17(20)19(22)24)18(23)211015(262)273h491417H1011H213H3(H2123)
MFCD08743922
N(22dimethoxyethyl)2(4methoxyphenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
ZINC000009135008
ZINC000013623620
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