(E)-3-(4-methylsulfanylphenyl)-1-[4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-methylsulfanylphenyl)-1-[4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]prop-2-en-1-one Openeye Name: (E)-3-(4-methylsulfanylphenyl)-1-[4-(2-morpholino-2-oxo-ethoxy)phenyl]prop-2-en-1-one CAS Name: (E)-3-[4-(methylthio)phenyl]-1-[4-[2-(4-morpholinyl)-2-oxoethoxy]phenyl]-2-propen-1-one IUPAC Name: (E)-3-(4-methylsulfanylphenyl)-1-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]prop-2-en-1-one Traditional Name: (E)-1-[4-(2-keto-2-morpholino-ethoxy)phenyl]-3-[4-(methylthio)phenyl]prop-2-en-1-one Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)OCC(=O)N3CCOCC3

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)OCC(=O)N3CCOCC3

InChI

InChI=1S/C22H23NO4S/c1-28-20-9-2-17(3-10-20)4-11-21(24)18-5-7-19(8-6-18)27-16-22(25)23-12-14-26-15-13-23/h2-11H,12-16H2,1H3/b11-4+