(4E)-2-(4-tert-butylphenyl)-4-[(7-methyl-2-phenylsulfanyl-quinolin-3-yl)methylidene]-1,3-oxazol-5-one

Systemtic Name: (4E)-2-(4-tert-butylphenyl)-4-[(7-methyl-2-phenylsulfanyl-quinolin-3-yl)methylidene]-1,3-oxazol-5-one Openeye Name: (4E)-2-(4-tert-butylphenyl)-4-[(7-methyl-2-phenylsulfanyl-3-quinolyl)methylene]oxazol-5-one CAS Name: (4E)-2-(4-tert-butylphenyl)-4-[[7-methyl-2-(phenylthio)-3-quinolinyl]methylidene]-5-oxazolone IUPAC Name: (4E)-2-(4-tert-butylphenyl)-4-[(7-methyl-2-phenylsulfanylquinolin-3-yl)methylidene]-1,3-oxazol-5-one Traditional Name: (4E)-2-(4-tert-butylphenyl)-4-[[7-methyl-2-(phenylthio)-3-quinolyl]methylene]-2-oxazolin-5-one Formula: C30H26N2O2S MolecularWeight: 478.60464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C=C3C(=O)OC(=N3)C4=CC=C(C=C4)C(C)(C)C)SC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)/C=C/3\C(=O)OC(=N3)C4=CC=C(C=C4)C(C)(C)C)SC5=CC=CC=C5

InChI

InChI=1S/C30H26N2O2S/c1-19-10-11-21-17-22(28(32-25(21)16-19)35-24-8-6-5-7-9-24)18-26-29(33)34-27(31-26)20-12-14-23(15-13-20)30(2,3)4/h5-18H,1-4H3/b26-18+