5-[[1-ethyl-4-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxidanylidene-quinolin-3-yl]methylidene]-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[[1-ethyl-4-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxidanylidene-quinolin-3-yl]methylidene]-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[[1-ethyl-4-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxo-3-quinolyl]methylene]-3-phenethyl-2-thioxo-thiazolidin-4-one CAS Name: 5-[[1-ethyl-4-[4-(2-hydroxyethyl)-1-piperazinyl]-2-oxo-3-quinolinyl]methylidene]-3-phenethyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[1-ethyl-4-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoquinolin-3-yl]methylidene]-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-[[1-ethyl-4-[4-(2-hydroxyethyl)piperazino]-2-keto-3-quinolyl]methylene]-3-phenethyl-2-thioxo-thiazolidin-4-one Formula: C29H32N4O3S2 MolecularWeight: 548.71938

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)N5CCN(CC5)CCO

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)N5CCN(CC5)CCO

InChI

InChI=1S/C29H32N4O3S2/c1-2-32-24-11-7-6-10-22(24)26(31-16-14-30(15-17-31)18-19-34)23(27(32)35)20-25-28(36)33(29(37)38-25)13-12-21-8-4-3-5-9-21/h3-11,20,34H,2,12-19H2,1H3