(5E)-5-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methylidene]-3-(3-morpholin-4-ium-4-ylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5E)-5-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methylidene]-3-(3-morpholin-4-ium-4-ylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5E)-5-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methylene]-3-(3-morpholin-4-ium-4-ylpropyl)-2-thioxo-thiazolidin-4-one CAS Name: (5E)-5-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methylidene]-3-[3-(4-morpholin-4-iumyl)propyl]-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5E)-5-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methylidene]-3-(3-morpholin-4-ium-4-ylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5E)-5-[(2-keto-7-methoxy-1H-quinolin-3-yl)methylene]-3-(3-morpholin-4-ium-4-ylpropyl)-2-thioxo-thiazolidin-4-one Formula: C21H24N3O4S2+ MolecularWeight: 446.56296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)C=C3C(=O)N(C(=S)S3)CCC[NH+]4CCOCC4

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)/C=C/3\C(=O)N(C(=S)S3)CCC[NH+]4CCOCC4

InChI

InChI=1S/C21H23N3O4S2/c1-27-16-4-3-14-11-15(19(25)22-17(14)13-16)12-18-20(26)24(21(29)30-18)6-2-5-23-7-9-28-10-8-23/h3-4,11-13H,2,5-10H2,1H3,(H,22,25)/p+1/b18-12+