(5E)-2-(4-methylpiperidin-1-yl)-5-[(3-phenoxyphenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: (5E)-2-(4-methylpiperidin-1-yl)-5-[(3-phenoxyphenyl)methylidene]-1,3-thiazol-4-one Openeye Name: (5E)-2-(4-methyl-1-piperidyl)-5-[(3-phenoxyphenyl)methylene]thiazol-4-one CAS Name: (5E)-2-(4-methyl-1-piperidinyl)-5-[(3-phenoxyphenyl)methylidene]-4-thiazolone IUPAC Name: (5E)-2-(4-methylpiperidin-1-yl)-5-[(3-phenoxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5E)-2-(4-methylpiperidino)-5-(3-phenoxybenzylidene)-2-thiazolin-4-one Formula: C22H22N2O2S MolecularWeight: 378.48728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC(=O)C(=CC3=CC(=CC=C3)OC4=CC=CC=C4)S2

Isomeric SMILES

CC1CCN(CC1)C2=NC(=O)/C(=C\C3=CC(=CC=C3)OC4=CC=CC=C4)/S2

InChI

InChI=1S/C22H22N2O2S/c1-16-10-12-24(13-11-16)22-23-21(25)20(27-22)15-17-6-5-9-19(14-17)26-18-7-3-2-4-8-18/h2-9,14-16H,10-13H2,1H3/b20-15+