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

Systemtic Name: ethyl 1-[3-[[3-(3-ethoxypropyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1-methyl-2-oxidanylidene-quinolin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-[[3-(3-ethoxypropyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]-1-methyl-2-oxo-4-quinolyl]piperidine-4-carboxylate CAS Name: 1-[3-[[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-1-methyl-2-oxo-4-quinolinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1-methyl-2-oxoquinolin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[3-[[3-(3-ethoxypropyl)-4-keto-2-thioxo-thiazolidin-5-ylidene]methyl]-2-keto-1-methyl-4-quinolyl]isonipecotic acid ethyl ester Formula: C27H33N3O5S2 MolecularWeight: 543.69802

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C(=CC2=C(C3=CC=CC=C3N(C2=O)C)N4CCC(CC4)C(=O)OCC)SC1=S

Isomeric SMILES

CCOCCCN1C(=O)C(=CC2=C(C3=CC=CC=C3N(C2=O)C)N4CCC(CC4)C(=O)OCC)SC1=S

InChI

InChI=1S/C27H33N3O5S2/c1-4-34-16-8-13-30-25(32)22(37-27(30)36)17-20-23(19-9-6-7-10-21(19)28(3)24(20)31)29-14-11-18(12-15-29)26(33)35-5-2/h6-7,9-10,17-18H,4-5,8,11-16H2,1-3H3