Vitas-M small molecule compound
(3aS,6R,7R,7aS)-N-cyclopropyl-2-[2-(1H-indol-3-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Catalog ID
STL537935
SMILES O=C([C@H]1[C@@H]2C=C[C@@]3([C@H]1C(=O)N(C3)CCc1c[nH]c3c1cccc3)O2)NC1CC1
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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 C22H23N3O3 MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O3/c26-20(24-14-5-6-14)18-17-7-9-22(28-17)12-25(21(27)19(18)22)10-8-13-11-23-16-4-2-1-3-15(13)16/h1-4,7,9,11,14,17-19,23H,5-6,8,10,12H2,(H,24,26)/t17-,18+,19-,22-/m1/s1InChIKey
UMKQPCNEQUXZCN-VQQMMKBISA-NSynonyms
(1~(S)5~(S)6~(R)7~(R))~(N)cyclopropyl3(2(1~(H)indol3yl)ethyl)4oxo10oxa3azatricyclo(5210^(15))dec8ene6carboxamide
(3aS6R7R7aS)2(2(1Hindol3yl)ethyl)Ncyclopropyl1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
(3aS6R7R7aS)Ncyclopropyl2(2(1Hindol3yl)ethyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
92504212
InChI=1SC22H23N3O3c2620(24145614)18177922(2817)1225(21(27)19(18)22)10813112316421315(13)16h14791114171923H5681012H2(H2426)t1718+1922m1s1
O=C((C@H)1(C@@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)CCc1c(nH)c3c1cccc3)O2)NC1CC1
ZINC000015894288
ZINC15894288
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