Vitas-M small molecule compound
(3aS,6R)-N-(2-chlorobenzyl)-2-(furan-2-ylmethyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Catalog ID
STK630501
SMILES O=C(C1[C@@H]2C=C[C@@]3(C1C(=O)N(C3)Cc1ccco1)O2)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 C21H19ClN2O4 MW 398.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O4/c22-15-6-2-1-4-13(15)10-23-19(25)17-16-7-8-21(28-16)12-24(20(26)18(17)21)11-14-5-3-9-27-14/h1-9,16-18H,10-12H2,(H,23,25)/t16-,17?,18?,21-/m1/s1InChIKey
ATDKRWXYQGLGHE-FRVUEHSBSA-NSynonyms
(3aS6R)N(2chlorobenzyl)2(furan2ylmethyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
MFCD18246523
O=C((C@@H)1(C@H)2C=C(C@@)3((C@H)1C(=O)N(C3)Cc1ccco1)O2)NCc1ccccc1Cl
O=C(C1(C@@H)2C=C(C@@)3(C1C(=O)N(C3)Cc1ccco1)O2)NCc1ccccc1Cl
ZINC000013628941
ZINC000013628949
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