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

Systemtic Name: ethyl 4-[1-methyl-2-oxidanylidene-3-[[4-oxidanylidene-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]quinolin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-methyl-2-oxo-3-[[4-oxo-3-(1-phenylethyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-4-quinolyl]piperazine-1-carboxylate CAS Name: 4-[1-methyl-2-oxo-3-[[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]-4-quinolinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-methyl-2-oxo-3-[[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]quinolin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[2-keto-3-[[4-keto-3-(1-phenylethyl)-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)C(C)C5=CC=CC=C5

Isomeric SMILES

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

InChI

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