(5E)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-3-phenyl-5-(pyridin-3-ylmethylidene)imidazol-4-one

Systemtic Name: (5E)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-3-phenyl-5-(pyridin-3-ylmethylidene)imidazol-4-one Openeye Name: (5E)-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-3-phenyl-5-(3-pyridylmethylene)imidazol-4-one CAS Name: (5E)-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-3-phenyl-5-(3-pyridinylmethylidene)-4-imidazolone IUPAC Name: (5E)-2-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-3-phenyl-5-(pyridin-3-ylmethylidene)imidazol-4-one Traditional Name: (5E)-2-[(2-keto-2-piperidino-ethyl)thio]-3-phenyl-5-(3-pyridylmethylene)-2-imidazolin-4-one Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NC(=CC3=CN=CC=C3)C(=O)N2C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=N/C(=C/C3=CN=CC=C3)/C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C22H22N4O2S/c27-20(25-12-5-2-6-13-25)16-29-22-24-19(14-17-8-7-11-23-15-17)21(28)26(22)18-9-3-1-4-10-18/h1,3-4,7-11,14-15H,2,5-6,12-13,16H2/b19-14+