ethyl 1-[1-methyl-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-methyl-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-methyl-2-oxo-3-[[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-4-quinolyl]piperidine-4-carboxylate CAS Name: 1-[1-methyl-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-methyl-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-[2-keto-3-[[4-keto-3-(tetrahydrofurfuryl)-2-thioxo-thiazolidin-5-ylidene]methyl]-1-methyl-4-quinolyl]isonipecotic acid ethyl ester Formula: C27H31N3O5S2 MolecularWeight: 541.68214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C(=O)N(C3=CC=CC=C32)C)C=C4C(=O)N(C(=S)S4)CC5CCCO5

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C(=O)N(C3=CC=CC=C32)C)C=C4C(=O)N(C(=S)S4)CC5CCCO5

InChI

InChI=1S/C27H31N3O5S2/c1-3-34-26(33)17-10-12-29(13-11-17)23-19-8-4-5-9-21(19)28(2)24(31)20(23)15-22-25(32)30(27(36)37-22)16-18-7-6-14-35-18/h4-5,8-9,15,17-18H,3,6-7,10-14,16H2,1-2H3