Vitas-M small molecule compound
2-(4-chlorophenyl)-N-(5-hydroxypentyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Catalog ID
STL058374
SMILES OCCCCCNC(=O)C1C2C=CC3(C1C(=O)N(C3)c1ccc(cc1)Cl)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 C20H23ClN2O4 MW 390.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN2O4/c21-13-4-6-14(7-5-13)23-12-20-9-8-15(27-20)16(17(20)19(23)26)18(25)22-10-2-1-3-11-24/h4-9,15-17,24H,1-3,10-12H2,(H,22,25)InChIKey
QWIIRNVGEHCIGT-UHFFFAOYSA-NSynonyms
1212070-61-5(6R)2(4chlorophenyl)N(5hydroxypentyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
1212070615
2(4chlorophenyl)N(5hydroxypentyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
C1C23C=CC(O2)C(C3C(=O)N1C4=CC=C(C=C4)Cl)C(=O)NCCCCCO
InChI=1SC20H23ClN2O4c21134614(7513)2312209815(2720)16(17(20)19(23)26)18(25)22102131124h49151724H131012H2(H2225)
MFCD08290815
OCCCCCNC(=O)(C@@H)1(C@H)2C=C(C@)3((C@H)1C(=O)N(C3)c1ccc(cc1)Cl)O2
ZINC000101423065
ZINC000101423074
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