ethyl 1-[3-[(3-butan-2-yl-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-butan-2-yl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-methyl-2-oxidanylidene-quinolin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[1-methyl-2-oxo-3-[(4-oxo-3-sec-butyl-2-thioxo-thiazolidin-5-ylidene)methyl]-4-quinolyl]piperidine-4-carboxylate CAS Name: 1-[3-[(3-butan-2-yl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-1-methyl-2-oxo-4-quinolinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(3-butan-2-yl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-methyl-2-oxoquinolin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[2-keto-3-[(4-keto-3-sec-butyl-2-thioxo-thiazolidin-5-ylidene)methyl]-1-methyl-4-quinolyl]isonipecotic acid ethyl ester Formula: C26H31N3O4S2 MolecularWeight: 513.67204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=CC2=C(C3=CC=CC=C3N(C2=O)C)N4CCC(CC4)C(=O)OCC)SC1=S

Isomeric SMILES

CCC(C)N1C(=O)C(=CC2=C(C3=CC=CC=C3N(C2=O)C)N4CCC(CC4)C(=O)OCC)SC1=S

InChI

InChI=1S/C26H31N3O4S2/c1-5-16(3)29-24(31)21(35-26(29)34)15-19-22(18-9-7-8-10-20(18)27(4)23(19)30)28-13-11-17(12-14-28)25(32)33-6-2/h7-10,15-17H,5-6,11-14H2,1-4H3