Vitas-M small molecule compound
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-methyl-1,2-oxazol-3-yl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Catalog ID
STL239752
SMILES COc1cc(CCNC(=O)C2C3C=CC4(C2C(=O)N(C4)c2noc(c2)C)O3)ccc1OC
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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 C23H25N3O6 MW 439.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O6/c1-13-10-18(25-32-13)26-12-23-8-6-16(31-23)19(20(23)22(26)28)21(27)24-9-7-14-4-5-15(29-2)17(11-14)30-3/h4-6,8,10-11,16,19-20H,7,9,12H2,1-3H3,(H,24,27)InChIKey
WNDGURXLUQSKEF-UHFFFAOYSA-NSynonyms
(3aS6R)N(34dimethoxyphenethyl)2(5methylisoxazol3yl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
CC1=CC(=NO1)N2CC34C=CC(O3)C(C4C2=O)C(=O)NCCC5=CC(=C(C=C5)OC)OC
COc1cc(CCNC(=O)(C@@H)2(C@H)3C=C(C@)4((C@H)2C(=O)N(C4)c2noc(c2)C)O3)ccc1OC
InChI=1SC23H25N3O6c1131018(253213)2612238616(3123)19(20(23)22(26)28)21(27)2497144515(292)17(1114)303h4681011161920H7912H213H3(H2427)
MFCD08746197
N(2(34dimethoxyphenyl)ethyl)2(5methyl12oxazol3yl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
ZINC000101351952
ZINC000252430973
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