(4E)-2-(4-chlorophenyl)-4-[(8-methyl-2-phenylsulfanyl-quinolin-3-yl)methylidene]-1,3-oxazol-5-one

Systemtic Name: (4E)-2-(4-chlorophenyl)-4-[(8-methyl-2-phenylsulfanyl-quinolin-3-yl)methylidene]-1,3-oxazol-5-one Openeye Name: (4E)-2-(4-chlorophenyl)-4-[(8-methyl-2-phenylsulfanyl-3-quinolyl)methylene]oxazol-5-one CAS Name: (4E)-2-(4-chlorophenyl)-4-[[8-methyl-2-(phenylthio)-3-quinolinyl]methylidene]-5-oxazolone IUPAC Name: (4E)-2-(4-chlorophenyl)-4-[(8-methyl-2-phenylsulfanylquinolin-3-yl)methylidene]-1,3-oxazol-5-one Traditional Name: (4E)-2-(4-chlorophenyl)-4-[[8-methyl-2-(phenylthio)-3-quinolyl]methylene]-2-oxazolin-5-one Formula: C26H17ClN2O2S MolecularWeight: 456.94338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C(N=C12)SC3=CC=CC=C3)C=C4C(=O)OC(=N4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC=CC2=CC(=C(N=C12)SC3=CC=CC=C3)/C=C/4\C(=O)OC(=N4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H17ClN2O2S/c1-16-6-5-7-18-14-19(25(29-23(16)18)32-21-8-3-2-4-9-21)15-22-26(30)31-24(28-22)17-10-12-20(27)13-11-17/h2-15H,1H3/b22-15+