ethyl 4-[1-methyl-3-[[3-[(4-methylphenyl)methyl]-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-[(4-methylphenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-oxidanylidene-quinolin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-methyl-2-oxo-3-[[4-oxo-3-(p-tolylmethyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-4-quinolyl]piperazine-1-carboxylate CAS Name: 4-[1-methyl-3-[[3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-2-oxo-4-quinolinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-methyl-3-[[3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-oxoquinolin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[2-keto-3-[[4-keto-3-(4-methylbenzyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-1-methyl-4-quinolyl]piperazine-1-carboxylic acid ethyl ester Formula: C29H30N4O4S2 MolecularWeight: 562.7029

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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)CC5=CC=C(C=C5)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C(=O)N(C3=CC=CC=C32)C)C=C4C(=O)N(C(=S)S4)CC5=CC=C(C=C5)C

InChI

InChI=1S/C29H30N4O4S2/c1-4-37-28(36)32-15-13-31(14-16-32)25-21-7-5-6-8-23(21)30(3)26(34)22(25)17-24-27(35)33(29(38)39-24)18-20-11-9-19(2)10-12-20/h5-12,17H,4,13-16,18H2,1-3H3