Vitas-M small molecule compound
ethyl 4-({(3aS,6R)-2-[4-(acetylamino)phenyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindol-7-yl}carbonyl)piperazine-1-carboxylate
Catalog ID
STK619143
SMILES CCOC(=O)N1CCN(CC1)C(=O)C1[C@@H]2C=C[C@@]3(C1C(=O)N(C3)c1ccc(cc1)NC(=O)C)O2
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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 C24H28N4O6 MW 468.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4O6/c1-3-33-23(32)27-12-10-26(11-13-27)21(30)19-18-8-9-24(34-18)14-28(22(31)20(19)24)17-6-4-16(5-7-17)25-15(2)29/h4-9,18-20H,3,10-14H2,1-2H3,(H,25,29)/t18-,19?,20?,24-/m1/s1InChIKey
JNTKIPINKPMEEC-MEEXBRHZSA-NSynonyms
1212469-05-01212469050
CCOC(=O)N1CCN(CC1)C(=O)(C@@H)1(C@H)2C=C(C@@)3((C@H)1C(=O)N(C3)c1ccc(cc1)NC(=O)C)O2
CCOC(=O)N1CCN(CC1)C(=O)C1(C@@H)2C=C(C@@)3(C1C(=O)N(C3)c1ccc(cc1)NC(=O)C)O2
ethyl4(((3aS6R)2(4(acetylamino)phenyl)1oxo123677ahexahydro3a6epoxyisoindol7yl)carbonyl)piperazine1carboxylate
ethyl4((3aS6R)2(4acetamidophenyl)1oxo123677ahexahydro3a6epoxyisoindole7carbonyl)piperazine1carboxylate
MFCD18246366
ZINC000013629857
ZINC000015905651
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