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

Systemtic Name: 1-[1-methyl-3-[[3-[(4-methylphenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-oxidanylidene-quinolin-4-yl]piperidine-4-carboxamide Openeye Name: 1-[1-methyl-2-oxo-3-[[4-oxo-3-(p-tolylmethyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-4-quinolyl]piperidine-4-carboxamide CAS Name: 1-[1-methyl-3-[[3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-2-oxo-4-quinolinyl]-4-piperidinecarboxamide IUPAC Name: 1-[1-methyl-3-[[3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-oxoquinolin-4-yl]piperidine-4-carboxamide Traditional Name: 1-[2-keto-3-[[4-keto-3-(4-methylbenzyl)-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:

CC1=CC=C(C=C1)CN2C(=O)C(=CC3=C(C4=CC=CC=C4N(C3=O)C)N5CCC(CC5)C(=O)N)SC2=S

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C(=CC3=C(C4=CC=CC=C4N(C3=O)C)N5CCC(CC5)C(=O)N)SC2=S

InChI

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