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

Systemtic Name: 5-[[4-[4-(2-hydroxyethyl)piperazin-1-yl]-1-methyl-2-oxidanylidene-quinolin-3-yl]methylidene]-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[[4-[4-(2-hydroxyethyl)piperazin-1-yl]-1-methyl-2-oxo-3-quinolyl]methylene]-3-phenethyl-2-thioxo-thiazolidin-4-one CAS Name: 5-[[4-[4-(2-hydroxyethyl)-1-piperazinyl]-1-methyl-2-oxo-3-quinolinyl]methylidene]-3-phenethyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[4-[4-(2-hydroxyethyl)piperazin-1-yl]-1-methyl-2-oxoquinolin-3-yl]methylidene]-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-[[4-[4-(2-hydroxyethyl)piperazino]-2-keto-1-methyl-3-quinolyl]methylene]-3-phenethyl-2-thioxo-thiazolidin-4-one Formula: C28H30N4O3S2 MolecularWeight: 534.6928

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)N5CCN(CC5)CCO

Isomeric SMILES

CN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)N5CCN(CC5)CCO

InChI

InChI=1S/C28H30N4O3S2/c1-29-23-10-6-5-9-21(23)25(31-15-13-30(14-16-31)17-18-33)22(26(29)34)19-24-27(35)32(28(36)37-24)12-11-20-7-3-2-4-8-20/h2-10,19,33H,11-18H2,1H3