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

Systemtic Name: 5-[[1-ethyl-4-(4-methylpiperazin-1-yl)-2-oxidanylidene-quinolin-3-yl]methylidene]-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[[1-ethyl-4-(4-methylpiperazin-1-yl)-2-oxo-3-quinolyl]methylene]-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-thiazolidin-4-one CAS Name: 5-[[1-ethyl-4-(4-methyl-1-piperazinyl)-2-oxo-3-quinolinyl]methylidene]-3-(2-oxolanylmethyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[1-ethyl-4-(4-methylpiperazin-1-yl)-2-oxoquinolin-3-yl]methylidene]-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-[[1-ethyl-2-keto-4-(4-methylpiperazino)-3-quinolyl]methylene]-3-(tetrahydrofurfuryl)-2-thioxo-thiazolidin-4-one Formula: C25H30N4O3S2 MolecularWeight: 498.6607

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)CC4CCCO4)N5CCN(CC5)C

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)CC4CCCO4)N5CCN(CC5)C

InChI

InChI=1S/C25H30N4O3S2/c1-3-28-20-9-5-4-8-18(20)22(27-12-10-26(2)11-13-27)19(23(28)30)15-21-24(31)29(25(33)34-21)16-17-7-6-14-32-17/h4-5,8-9,15,17H,3,6-7,10-14,16H2,1-2H3