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

Systemtic Name: 5-[[4-(azepan-1-yl)-1-methyl-2-oxidanylidene-quinolin-3-yl]methylidene]-3-butyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[[4-(azepan-1-yl)-1-methyl-2-oxo-3-quinolyl]methylene]-3-butyl-2-thioxo-thiazolidin-4-one CAS Name: 5-[[4-(1-azepanyl)-1-methyl-2-oxo-3-quinolinyl]methylidene]-3-butyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[4-(azepan-1-yl)-1-methyl-2-oxoquinolin-3-yl]methylidene]-3-butyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-[[4-(azepan-1-yl)-2-keto-1-methyl-3-quinolyl]methylene]-3-butyl-2-thioxo-thiazolidin-4-one Formula: C24H29N3O2S2 MolecularWeight: 455.63596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=C(C3=CC=CC=C3N(C2=O)C)N4CCCCCC4)SC1=S

Isomeric SMILES

CCCCN1C(=O)C(=CC2=C(C3=CC=CC=C3N(C2=O)C)N4CCCCCC4)SC1=S

InChI

InChI=1S/C24H29N3O2S2/c1-3-4-15-27-23(29)20(31-24(27)30)16-18-21(26-13-9-5-6-10-14-26)17-11-7-8-12-19(17)25(2)22(18)28/h7-8,11-12,16H,3-6,9-10,13-15H2,1-2H3