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

Systemtic Name: (4E)-2-(3,4-dimethoxyphenyl)-4-[(8-methyl-2-phenylsulfanyl-quinolin-3-yl)methylidene]-1,3-oxazol-5-one Openeye Name: (4E)-2-(3,4-dimethoxyphenyl)-4-[(8-methyl-2-phenylsulfanyl-3-quinolyl)methylene]oxazol-5-one CAS Name: (4E)-2-(3,4-dimethoxyphenyl)-4-[[8-methyl-2-(phenylthio)-3-quinolinyl]methylidene]-5-oxazolone IUPAC Name: (4E)-2-(3,4-dimethoxyphenyl)-4-[(8-methyl-2-phenylsulfanylquinolin-3-yl)methylidene]-1,3-oxazol-5-one Traditional Name: (4E)-2-(3,4-dimethoxyphenyl)-4-[[8-methyl-2-(phenylthio)-3-quinolyl]methylene]-2-oxazolin-5-one Formula: C28H22N2O4S MolecularWeight: 482.55028

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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)OC)OC

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)OC)OC

InChI

InChI=1S/C28H22N2O4S/c1-17-8-7-9-18-14-20(27(30-25(17)18)35-21-10-5-4-6-11-21)15-22-28(31)34-26(29-22)19-12-13-23(32-2)24(16-19)33-3/h4-16H,1-3H3/b22-15+