1-methyl-N-(4-morpholin-4-ylphenyl)-4-[2-(4-phenyl-2-sulfanylidene-imidazolidin-1-yl)ethanoyl-(pyridin-3-ylmethyl)amino]piperidine-4-carboxamide

Systemtic Name: 1-methyl-N-(4-morpholin-4-ylphenyl)-4-[2-(4-phenyl-2-sulfanylidene-imidazolidin-1-yl)ethanoyl-(pyridin-3-ylmethyl)amino]piperidine-4-carboxamide Openeye Name: 1-methyl-N-(4-morpholinophenyl)-4-[[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]-(3-pyridylmethyl)amino]piperidine-4-carboxamide CAS Name: 1-methyl-N-[4-(4-morpholinyl)phenyl]-4-[[1-oxo-2-(4-phenyl-2-sulfanylidene-1-imidazolidinyl)ethyl]-(3-pyridinylmethyl)amino]-4-piperidinecarboxamide IUPAC Name: 1-methyl-N-(4-morpholin-4-ylphenyl)-4-[[2-(4-phenyl-2-sulfanylideneimidazolidin-1-yl)acetyl]-(pyridin-3-ylmethyl)amino]piperidine-4-carboxamide Traditional Name: 1-methyl-N-(4-morpholinophenyl)-4-[[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]-(3-pyridylmethyl)amino]isonipecotamide Formula: C34H41N7O3S MolecularWeight: 627.79944

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(C(=O)NC2=CC=C(C=C2)N3CCOCC3)N(CC4=CN=CC=C4)C(=O)CN5CC(NC5=S)C6=CC=CC=C6

Isomeric SMILES

CN1CCC(CC1)(C(=O)NC2=CC=C(C=C2)N3CCOCC3)N(CC4=CN=CC=C4)C(=O)CN5CC(NC5=S)C6=CC=CC=C6

InChI

InChI=1S/C34H41N7O3S/c1-38-16-13-34(14-17-38,32(43)36-28-9-11-29(12-10-28)39-18-20-44-21-19-39)41(23-26-6-5-15-35-22-26)31(42)25-40-24-30(37-33(40)45)27-7-3-2-4-8-27/h2-12,15,22,30H,13-14,16-21,23-25H2,1H3,(H,36,43)(H,37,45)