Vitas-M small molecule compound
(3aS,6R,7R,7aS)-N-(furan-2-ylmethyl)-2-[2-(1H-indol-3-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Catalog ID
STL537887
SMILES O=C([C@H]1[C@@H]2C=C[C@@]3([C@H]1C(=O)N(C3)CCc1c[nH]c3c1cccc3)O2)NCc1ccco1
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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 C24H23N3O4 MW 417.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O4/c28-22(26-13-16-4-3-11-30-16)20-19-7-9-24(31-19)14-27(23(29)21(20)24)10-8-15-12-25-18-6-2-1-5-17(15)18/h1-7,9,11-12,19-21,25H,8,10,13-14H2,(H,26,28)/t19-,20+,21-,24-/m1/s1InChIKey
PJMCVSPUJCDYCE-OOICKAIWSA-NSynonyms
(1~(S)5~(S)6~(R)7~(R))~(N)(furan2ylmethyl)3(2(1~(H)indol3yl)ethyl)4oxo10oxa3azatricyclo(5210^(15))dec8ene6carboxamide
(3aS6R7R7aS)2(2(1Hindol3yl)ethyl)N(furan2ylmethyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
(3aS6R7R7aS)N(furan2ylmethyl)2(2(1Hindol3yl)ethyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
25582093
InChI=1SC24H23N3O4c2822(26131643113016)20197924(3119)1427(23(29)21(20)24)10815122518621517(15)18h1791112192125H8101314H2(H2628)t1920+2124m1s1
O=C((C@@H)1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)CCc1c(nH)c3c1cccc3)O2)NCc1ccco1
ZINC000012892353
ZINC12892353
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