(5E)-3-(2,5-dimethylpyrrol-1-yl)-5-[[4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5E)-3-(2,5-dimethylpyrrol-1-yl)-5-[[4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5E)-3-(2,5-dimethylpyrrol-1-yl)-5-[[4-(2-morpholino-2-oxo-ethoxy)phenyl]methylene]-2-thioxo-thiazolidin-4-one CAS Name: (5E)-3-(2,5-dimethyl-1-pyrrolyl)-5-[[4-[2-(4-morpholinyl)-2-oxoethoxy]phenyl]methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5E)-3-(2,5-dimethylpyrrol-1-yl)-5-[[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5E)-3-(2,5-dimethylpyrrol-1-yl)-5-[4-(2-keto-2-morpholino-ethoxy)benzylidene]-2-thioxo-thiazolidin-4-one Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1N2C(=O)C(=CC3=CC=C(C=C3)OCC(=O)N4CCOCC4)SC2=S)C

Isomeric SMILES

CC1=CC=C(N1N2C(=O)/C(=C\C3=CC=C(C=C3)OCC(=O)N4CCOCC4)/SC2=S)C

InChI

InChI=1S/C22H23N3O4S2/c1-15-3-4-16(2)24(15)25-21(27)19(31-22(25)30)13-17-5-7-18(8-6-17)29-14-20(26)23-9-11-28-12-10-23/h3-8,13H,9-12,14H2,1-2H3/b19-13+