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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=CC2=C(C3=CC=CC=C3N(C2=O)C)N4CCCC4)SC1=S

Isomeric SMILES

CCC(C)N1C(=O)C(=CC2=C(C3=CC=CC=C3N(C2=O)C)N4CCCC4)SC1=S

InChI

InChI=1S/C22H25N3O2S2/c1-4-14(2)25-21(27)18(29-22(25)28)13-16-19(24-11-7-8-12-24)15-9-5-6-10-17(15)23(3)20(16)26/h5-6,9-10,13-14H,4,7-8,11-12H2,1-3H3