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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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