Vitas-M small molecule compound
2-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Catalog ID
STK264055
SMILES COc1c(cccc1OC)/C=N/N1C(=O)C2C(C1=O)C1C=CC2C2C1C2
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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 C20H20N2O4 MW 352.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O4/c1-25-15-5-3-4-10(18(15)26-2)9-21-22-19(23)16-11-6-7-12(14-8-13(11)14)17(16)20(22)24/h3-7,9,11-14,16-17H,8H2,1-2H3/b21-9+InChIKey
XMHDEEIHFNLZDA-ZVBGSRNCSA-NSynonyms
2(((E)(23DIMETHOXYPHENYL)METHYLIDENE)AMINO)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
COC1=CC=CC(=C1OC)C=NN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
COc1c(cccc1OC)C=NN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
InChI=1SC20H20N2O4c1251553410(18(15)262)9212219(23)16116712(14813(11)14)17(16)20(22)24h37911141617H8H212H3b219+
MFCD03557260
ZINC000245227045
ZINC000245227048
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