1-(furan-2-yl)-3-(4-methylsulfanylphenyl)-2,3-dimorpholin-4-yl-propan-1-one

Systemtic Name: 1-(furan-2-yl)-3-(4-methylsulfanylphenyl)-2,3-dimorpholin-4-yl-propan-1-one Openeye Name: 1-(2-furyl)-3-(4-methylsulfanylphenyl)-2,3-dimorpholino-propan-1-one CAS Name: 1-(2-furanyl)-3-[4-(methylthio)phenyl]-2,3-bis(4-morpholinyl)-1-propanone IUPAC Name: 1-(furan-2-yl)-3-(4-methylsulfanylphenyl)-2,3-dimorpholin-4-ylpropan-1-one Traditional Name: 1-(2-furyl)-3-[4-(methylthio)phenyl]-2,3-dimorpholino-propan-1-one Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C(C(=O)C2=CC=CO2)N3CCOCC3)N4CCOCC4

Isomeric SMILES

CSC1=CC=C(C=C1)C(C(C(=O)C2=CC=CO2)N3CCOCC3)N4CCOCC4

InChI

InChI=1S/C22H28N2O4S/c1-29-18-6-4-17(5-7-18)20(23-8-13-26-14-9-23)21(24-10-15-27-16-11-24)22(25)19-3-2-12-28-19/h2-7,12,20-21H,8-11,13-16H2,1H3