5-[[1-ethyl-4-(4-methylpiperazin-1-yl)-2-oxidanylidene-quinolin-3-yl]methylidene]-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[[1-ethyl-4-(4-methylpiperazin-1-yl)-2-oxidanylidene-quinolin-3-yl]methylidene]-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-benzyl-5-[[1-ethyl-4-(4-methylpiperazin-1-yl)-2-oxo-3-quinolyl]methylene]-2-thioxo-thiazolidin-4-one CAS Name: 5-[[1-ethyl-4-(4-methyl-1-piperazinyl)-2-oxo-3-quinolinyl]methylidene]-3-(phenylmethyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: 3-benzyl-5-[[1-ethyl-4-(4-methylpiperazin-1-yl)-2-oxoquinolin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-benzyl-5-[[1-ethyl-2-keto-4-(4-methylpiperazino)-3-quinolyl]methylene]-2-thioxo-thiazolidin-4-one Formula: C27H28N4O2S2 MolecularWeight: 504.66682

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4)N5CCN(CC5)C

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4)N5CCN(CC5)C

InChI

InChI=1S/C27H28N4O2S2/c1-3-30-22-12-8-7-11-20(22)24(29-15-13-28(2)14-16-29)21(25(30)32)17-23-26(33)31(27(34)35-23)18-19-9-5-4-6-10-19/h4-12,17H,3,13-16,18H2,1-2H3