(4E)-2-(4-methoxyphenyl)-4-[(6-methyl-2-phenylsulfanyl-quinolin-3-yl)methylidene]-1,3-oxazol-5-one

Systemtic Name: (4E)-2-(4-methoxyphenyl)-4-[(6-methyl-2-phenylsulfanyl-quinolin-3-yl)methylidene]-1,3-oxazol-5-one Openeye Name: (4E)-2-(4-methoxyphenyl)-4-[(6-methyl-2-phenylsulfanyl-3-quinolyl)methylene]oxazol-5-one CAS Name: (4E)-2-(4-methoxyphenyl)-4-[[6-methyl-2-(phenylthio)-3-quinolinyl]methylidene]-5-oxazolone IUPAC Name: (4E)-2-(4-methoxyphenyl)-4-[(6-methyl-2-phenylsulfanylquinolin-3-yl)methylidene]-1,3-oxazol-5-one Traditional Name: (4E)-2-(4-methoxyphenyl)-4-[[6-methyl-2-(phenylthio)-3-quinolyl]methylene]-2-oxazolin-5-one Formula: C27H20N2O3S MolecularWeight: 452.5243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)SC3=CC=CC=C3)C=C4C(=O)OC(=N4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)SC3=CC=CC=C3)/C=C/4\C(=O)OC(=N4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H20N2O3S/c1-17-8-13-23-19(14-17)15-20(26(29-23)33-22-6-4-3-5-7-22)16-24-27(30)32-25(28-24)18-9-11-21(31-2)12-10-18/h3-16H,1-2H3/b24-16+