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

Systemtic Name: 5-[[4-(azepan-1-yl)-1-methyl-2-oxidanylidene-quinolin-3-yl]methylidene]-3-propyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[[4-(azepan-1-yl)-1-methyl-2-oxo-3-quinolyl]methylene]-3-propyl-2-thioxo-thiazolidin-4-one CAS Name: 5-[[4-(1-azepanyl)-1-methyl-2-oxo-3-quinolinyl]methylidene]-3-propyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[4-(azepan-1-yl)-1-methyl-2-oxoquinolin-3-yl]methylidene]-3-propyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-[[4-(azepan-1-yl)-2-keto-1-methyl-3-quinolyl]methylene]-3-propyl-2-thioxo-thiazolidin-4-one Formula: C23H27N3O2S2 MolecularWeight: 441.60938

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=CC2=C(C3=CC=CC=C3N(C2=O)C)N4CCCCCC4)SC1=S

Isomeric SMILES

CCCN1C(=O)C(=CC2=C(C3=CC=CC=C3N(C2=O)C)N4CCCCCC4)SC1=S

InChI

InChI=1S/C23H27N3O2S2/c1-3-12-26-22(28)19(30-23(26)29)15-17-20(25-13-8-4-5-9-14-25)16-10-6-7-11-18(16)24(2)21(17)27/h6-7,10-11,15H,3-5,8-9,12-14H2,1-2H3