1-[1-methyl-2-oxidanylidene-3-[[4-oxidanylidene-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]quinolin-4-yl]piperidine-4-carboxamide

Systemtic Name: 1-[1-methyl-2-oxidanylidene-3-[[4-oxidanylidene-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]quinolin-4-yl]piperidine-4-carboxamide Openeye Name: 1-[1-methyl-2-oxo-3-[[4-oxo-3-(1-phenylethyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-4-quinolyl]piperidine-4-carboxamide CAS Name: 1-[1-methyl-2-oxo-3-[[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]-4-quinolinyl]-4-piperidinecarboxamide IUPAC Name: 1-[1-methyl-2-oxo-3-[[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]quinolin-4-yl]piperidine-4-carboxamide Traditional Name: 1-[2-keto-3-[[4-keto-3-(1-phenylethyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-1-methyl-4-quinolyl]isonipecotamide Formula: C28H28N4O3S2 MolecularWeight: 532.67692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)C(=CC3=C(C4=CC=CC=C4N(C3=O)C)N5CCC(CC5)C(=O)N)SC2=S

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=O)C(=CC3=C(C4=CC=CC=C4N(C3=O)C)N5CCC(CC5)C(=O)N)SC2=S

InChI

InChI=1S/C28H28N4O3S2/c1-17(18-8-4-3-5-9-18)32-27(35)23(37-28(32)36)16-21-24(31-14-12-19(13-15-31)25(29)33)20-10-6-7-11-22(20)30(2)26(21)34/h3-11,16-17,19H,12-15H2,1-2H3,(H2,29,33)