ethyl 4-[1-methyl-2-oxidanylidene-3-[[4-oxidanylidene-3-(phenylmethyl)-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-(phenylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]quinolin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-[(3-benzyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-1-methyl-2-oxo-4-quinolyl]piperazine-1-carboxylate CAS Name: 4-[1-methyl-2-oxo-3-[[4-oxo-3-(phenylmethyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]-4-quinolinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-methyl-2-oxoquinolin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[3-[(3-benzyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-2-keto-1-methyl-4-quinolyl]piperazine-1-carboxylic acid ethyl ester Formula: C28H28N4O4S2 MolecularWeight: 548.67632

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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=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)CC5=CC=CC=C5

InChI

InChI=1S/C28H28N4O4S2/c1-3-36-27(35)31-15-13-30(14-16-31)24-20-11-7-8-12-22(20)29(2)25(33)21(24)17-23-26(34)32(28(37)38-23)18-19-9-5-4-6-10-19/h4-12,17H,3,13-16,18H2,1-2H3