1-[1-methyl-2-oxidanylidene-3-[[4-oxidanylidene-3-(3-phenylpropyl)-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-(3-phenylpropyl)-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-(3-phenylpropyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-4-quinolyl]piperidine-4-carboxamide CAS Name: 1-[1-methyl-2-oxo-3-[[4-oxo-3-(3-phenylpropyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]-4-quinolinyl]-4-piperidinecarboxamide IUPAC Name: 1-[1-methyl-2-oxo-3-[[4-oxo-3-(3-phenylpropyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]quinolin-4-yl]piperidine-4-carboxamide Traditional Name: 1-[2-keto-3-[[4-keto-3-(3-phenylpropyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-1-methyl-4-quinolyl]isonipecotamide Formula: C29H30N4O3S2 MolecularWeight: 546.7035

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)CCCC4=CC=CC=C4)N5CCC(CC5)C(=O)N

Isomeric SMILES

CN1C2=CC=CC=C2C(=C(C1=O)C=C3C(=O)N(C(=S)S3)CCCC4=CC=CC=C4)N5CCC(CC5)C(=O)N

InChI

InChI=1S/C29H30N4O3S2/c1-31-23-12-6-5-11-21(23)25(32-16-13-20(14-17-32)26(30)34)22(27(31)35)18-24-28(36)33(29(37)38-24)15-7-10-19-8-3-2-4-9-19/h2-6,8-9,11-12,18,20H,7,10,13-17H2,1H3,(H2,30,34)