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

Systemtic Name: ethyl 4-[1-methyl-3-[[3-(2-methylpropyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-oxidanylidene-quinolin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-[(3-isobutyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-1-methyl-2-oxo-4-quinolyl]piperazine-1-carboxylate CAS Name: 4-[1-methyl-3-[[3-(2-methylpropyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-2-oxo-4-quinolinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-methyl-3-[[3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-oxoquinolin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[3-[(3-isobutyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-2-keto-1-methyl-4-quinolyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H30N4O4S2 MolecularWeight: 514.6601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C(=O)N(C3=CC=CC=C32)C)C=C4C(=O)N(C(=S)S4)CC(C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C(=O)N(C3=CC=CC=C32)C)C=C4C(=O)N(C(=S)S4)CC(C)C

InChI

InChI=1S/C25H30N4O4S2/c1-5-33-24(32)28-12-10-27(11-13-28)21-17-8-6-7-9-19(17)26(4)22(30)18(21)14-20-23(31)29(15-16(2)3)25(34)35-20/h6-9,14,16H,5,10-13,15H2,1-4H3