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

Systemtic Name: ethyl 1-[3-[(3-cyclohexyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-ethyl-2-oxidanylidene-quinolin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-[(3-cyclohexyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-1-ethyl-2-oxo-4-quinolyl]piperidine-4-carboxylate CAS Name: 1-[3-[(3-cyclohexyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-1-ethyl-2-oxo-4-quinolinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(3-cyclohexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-ethyl-2-oxoquinolin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[3-[(3-cyclohexyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-1-ethyl-2-keto-4-quinolyl]isonipecotic acid ethyl ester Formula: C29H35N3O4S2 MolecularWeight: 553.7359

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)C4CCCCC4)N5CCC(CC5)C(=O)OCC

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)C4CCCCC4)N5CCC(CC5)C(=O)OCC

InChI

InChI=1S/C29H35N3O4S2/c1-3-31-23-13-9-8-12-21(23)25(30-16-14-19(15-17-30)28(35)36-4-2)22(26(31)33)18-24-27(34)32(29(37)38-24)20-10-6-5-7-11-20/h8-9,12-13,18-20H,3-7,10-11,14-17H2,1-2H3