5-[(1-methyl-2-oxidanylidene-4-pyrrolidin-1-yl-quinolin-3-yl)methylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[(1-methyl-2-oxidanylidene-4-pyrrolidin-1-yl-quinolin-3-yl)methylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-isobutyl-5-[(1-methyl-2-oxo-4-pyrrolidin-1-yl-3-quinolyl)methylene]-2-thioxo-thiazolidin-4-one CAS Name: 5-[[1-methyl-2-oxo-4-(1-pyrrolidinyl)-3-quinolinyl]methylidene]-3-(2-methylpropyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[(1-methyl-2-oxo-4-pyrrolidin-1-ylquinolin-3-yl)methylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-isobutyl-5-[(2-keto-1-methyl-4-pyrrolidino-3-quinolyl)methylene]-2-thioxo-thiazolidin-4-one Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C(=CC2=C(C3=CC=CC=C3N(C2=O)C)N4CCCC4)SC1=S

Isomeric SMILES

CC(C)CN1C(=O)C(=CC2=C(C3=CC=CC=C3N(C2=O)C)N4CCCC4)SC1=S

InChI

InChI=1S/C22H25N3O2S2/c1-14(2)13-25-21(27)18(29-22(25)28)12-16-19(24-10-6-7-11-24)15-8-4-5-9-17(15)23(3)20(16)26/h4-5,8-9,12,14H,6-7,10-11,13H2,1-3H3