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

Systemtic Name: 3-(4-methylsulfanylphenyl)-2,3-dimorpholin-4-yl-1-thiophen-2-yl-propan-1-one Openeye Name: 3-(4-methylsulfanylphenyl)-2,3-dimorpholino-1-(2-thienyl)propan-1-one CAS Name: 3-[4-(methylthio)phenyl]-2,3-bis(4-morpholinyl)-1-thiophen-2-yl-1-propanone IUPAC Name: 3-(4-methylsulfanylphenyl)-2,3-dimorpholin-4-yl-1-thiophen-2-ylpropan-1-one Traditional Name: 3-[4-(methylthio)phenyl]-2,3-dimorpholino-1-(2-thienyl)propan-1-one Formula: C22H28N2O3S2 MolecularWeight: 432.59932

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C(C(=O)C2=CC=CS2)N3CCOCC3)N4CCOCC4

Isomeric SMILES

CSC1=CC=C(C=C1)C(C(C(=O)C2=CC=CS2)N3CCOCC3)N4CCOCC4

InChI

InChI=1S/C22H28N2O3S2/c1-28-18-6-4-17(5-7-18)20(23-8-12-26-13-9-23)21(24-10-14-27-15-11-24)22(25)19-3-2-16-29-19/h2-7,16,20-21H,8-15H2,1H3