Vitas-M small molecule compound

2-[4-(acetylamino)phenyl]-N-[3-(morpholin-4-yl)propyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide

Catalog ID
STL241142
SMILES CC(=O)Nc1ccc(cc1)N1CC23C(C1=O)C(C(O3)C=C2)C(=O)NCCCN1CCOCC1

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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 C24H30N4O5 MW 454.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N4O5/c1-16(29)26-17-3-5-18(6-4-17)28-15-24-8-7-19(33-24)20(21(24)23(28)31)22(30)25-9-2-10-27-11-13-32-14-12-27/h3-8,19-21H,2,9-15H2,1H3,(H,25,30)(H,26,29)
InChIKey
MJJUIBIAKDGWHS-UHFFFAOYSA-N
Synonyms

(3aS6R)2(4acetamidophenyl)N(3morpholinopropyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
2(4(acetylamino)phenyl)N(3(morpholin4yl)propyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
CC(=O)NC1=CC=C(C=C1)N2CC34C=CC(O3)C(C4C2=O)C(=O)NCCCN5CCOCC5
CC(=O)Nc1ccc(cc1)N1C(C@)23(C@@H)(C1=O)(C@@H)((C@H)(O3)C=C2)C(=O)NCCCN1CCOCC1
InChI=1SC24H30N4O5c116(29)26173518(6417)2815248719(3324)20(21(24)23(28)31)22(30)25921027111332141227h381921H2915H21H3(H2530)(H2629)
MFCD08743577
ZINC000015905466
ZINC000015905470

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Available files

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