(5E)-1-ethanoyl-5-[(6-ethoxy-2-piperidin-1-yl-quinolin-1-ium-3-yl)methylidene]-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: (5E)-1-ethanoyl-5-[(6-ethoxy-2-piperidin-1-yl-quinolin-1-ium-3-yl)methylidene]-2-sulfanylidene-imidazolidin-4-one Openeye Name: (5E)-1-acetyl-5-[[6-ethoxy-2-(1-piperidyl)quinolin-1-ium-3-yl]methylene]-2-thioxo-imidazolidin-4-one CAS Name: (5E)-1-acetyl-5-[[6-ethoxy-2-(1-piperidinyl)-3-quinolin-1-iumyl]methylidene]-2-sulfanylidene-4-imidazolidinone IUPAC Name: (5E)-1-acetyl-5-[(6-ethoxy-2-piperidin-1-ylquinolin-1-ium-3-yl)methylidene]-2-sulfanylideneimidazolidin-4-one Traditional Name: (5E)-1-acetyl-5-[(6-ethoxy-2-piperidino-quinolin-1-ium-3-yl)methylene]-2-thioxo-4-imidazolidinone Formula: C22H25N4O3S+ MolecularWeight: 425.5239

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC(=C([NH+]=C2C=C1)N3CCCCC3)C=C4C(=O)NC(=S)N4C(=O)C

Isomeric SMILES

CCOC1=CC2=CC(=C([NH+]=C2C=C1)N3CCCCC3)/C=C/4\C(=O)NC(=S)N4C(=O)C

InChI

InChI=1S/C22H24N4O3S/c1-3-29-17-7-8-18-15(12-17)11-16(20(23-18)25-9-5-4-6-10-25)13-19-21(28)24-22(30)26(19)14(2)27/h7-8,11-13H,3-6,9-10H2,1-2H3,(H,24,28,30)/p+1/b19-13+