Vitas-M small molecule compound
2-[4-(acetylamino)phenyl]-N-(2-chlorobenzyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Catalog ID
STL058601
SMILES CC(=O)Nc1ccc(cc1)N1CC23C(C1=O)C(C(O3)C=C2)C(=O)NCc1ccccc1Cl
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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 C24H22ClN3O4 MW 451.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClN3O4/c1-14(29)27-16-6-8-17(9-7-16)28-13-24-11-10-19(32-24)20(21(24)23(28)31)22(30)26-12-15-4-2-3-5-18(15)25/h2-11,19-21H,12-13H2,1H3,(H,26,30)(H,27,29)InChIKey
KWNJKYNMIFLICX-UHFFFAOYSA-NSynonyms
1212243-23-6(3aS6R)2(4acetamidophenyl)N(2chlorobenzyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
1212243236
2(4(acetylamino)phenyl)N(2chlorobenzyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
CC(=O)NC1=CC=C(C=C1)N2CC34C=CC(O3)C(C4C2=O)C(=O)NCC5=CC=CC=C5Cl
CC(=O)Nc1ccc(cc1)N1C(C@)23(C@@H)(C1=O)(C@@H)((C@H)(O3)C=C2)C(=O)NCc1ccccc1Cl
InChI=1SC24H22ClN3O4c114(29)27166817(9716)281324111019(3224)20(21(24)23(28)31)22(30)261215423518(15)25h2111921H1213H21H3(H2630)(H2729)
MFCD08743540
ZINC000009134351
ZINC000013623516
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