ethyl 1-[1-ethyl-2-oxidanylidene-3-[[4-oxidanylidene-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]quinolin-4-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[1-ethyl-2-oxidanylidene-3-[[4-oxidanylidene-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]quinolin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[1-ethyl-2-oxo-3-[[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-4-quinolyl]piperidine-4-carboxylate CAS Name: 1-[1-ethyl-2-oxo-3-[[4-oxo-3-(2-oxolanylmethyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]-4-quinolinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-ethyl-2-oxo-3-[[4-oxo-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]quinolin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[1-ethyl-2-keto-3-[[4-keto-3-(tetrahydrofurfuryl)-2-thioxo-thiazolidin-5-ylidene]methyl]-4-quinolyl]isonipecotic acid ethyl ester Formula: C28H33N3O5S2 MolecularWeight: 555.70872

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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)N5CCC(CC5)C(=O)OCC

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)CC4CCCO4)N5CCC(CC5)C(=O)OCC

InChI

InChI=1S/C28H33N3O5S2/c1-3-30-22-10-6-5-9-20(22)24(29-13-11-18(12-14-29)27(34)35-4-2)21(25(30)32)16-23-26(33)31(28(37)38-23)17-19-8-7-15-36-19/h5-6,9-10,16,18-19H,3-4,7-8,11-15,17H2,1-2H3