ethyl 1-[1-ethyl-2-oxidanylidene-3-[(4-oxidanylidene-3-prop-2-enyl-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-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]quinolin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-[(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-1-ethyl-2-oxo-4-quinolyl]piperidine-4-carboxylate CAS Name: 1-[1-ethyl-2-oxo-3-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-5-thiazolidinylidene)methyl]-4-quinolinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-ethyl-2-oxo-3-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]quinolin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[3-[(3-allyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-1-ethyl-2-keto-4-quinolyl]isonipecotic acid ethyl ester Formula: C26H29N3O4S2 MolecularWeight: 511.65616

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)CC=C)N4CCC(CC4)C(=O)OCC

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)CC=C)N4CCC(CC4)C(=O)OCC

InChI

InChI=1S/C26H29N3O4S2/c1-4-13-29-24(31)21(35-26(29)34)16-19-22(27-14-11-17(12-15-27)25(32)33-6-3)18-9-7-8-10-20(18)28(5-2)23(19)30/h4,7-10,16-17H,1,5-6,11-15H2,2-3H3