Vitas-M small molecule compound
(3aR,6S)-N-cyclopentyl-2-[2-(1H-indol-3-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Catalog ID
STL533974
SMILES O=C(C1[C@H]2C=C[C@]3(C1C(=O)N(C3)CCc1c[nH]c3c1cccc3)O2)NC1CCCC1
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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 C24H27N3O3 MW 405.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O3/c28-22(26-16-5-1-2-6-16)20-19-9-11-24(30-19)14-27(23(29)21(20)24)12-10-15-13-25-18-8-4-3-7-17(15)18/h3-4,7-9,11,13,16,19-21,25H,1-2,5-6,10,12,14H2,(H,26,28)/t19-,20?,21?,24-/m0/s1InChIKey
BKUUIFFOXCFCCJ-YOTFRABOSA-NSynonyms
(1~(R)7~(S))~(N)cyclopentyl3(2(1~(H)indol3yl)ethyl)4oxo10oxa3azatricyclo(5210^(15))dec8ene6carboxamide
(3aR6S)2(2(1Hindol3yl)ethyl)Ncyclopentyl1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
(3aR6S)Ncyclopentyl2(2(1Hindol3yl)ethyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
132934022
InChI=1SC24H27N3O3c2822(2616512616)201991124(3019)1427(23(29)21(20)24)121015132518843717(15)18h3479111316192125H1256101214H2(H2628)t1920?21?24m0s1
O=C((C@@H)1(C@@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)CCc1c(nH)c3c1cccc3)O2)NC1CCCC1
ZINC000015894195
ZINC000015894198
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