(5E)-5-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-2-[(2-methylphenyl)amino]-1,3-thiazol-4-one

Systemtic Name: (5E)-5-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-2-[(2-methylphenyl)amino]-1,3-thiazol-4-one Openeye Name: (5E)-5-[(4-hydroxy-3-methoxy-5-nitro-phenyl)methylene]-2-(2-methylanilino)thiazol-4-one CAS Name: (5E)-5-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-2-(2-methylanilino)-4-thiazolone IUPAC Name: (5E)-5-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-2-(2-methylanilino)-1,3-thiazol-4-one Traditional Name: (5E)-5-(4-hydroxy-3-methoxy-5-nitro-benzylidene)-2-(o-toluidino)-2-thiazolin-4-one Formula: C18H15N3O5S MolecularWeight: 385.3938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=O)C(=CC3=CC(=C(C(=C3)OC)O)[N+](=O)[O-])S2

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=O)/C(=C\C3=CC(=C(C(=C3)OC)O)[N+](=O)[O-])/S2

InChI

InChI=1S/C18H15N3O5S/c1-10-5-3-4-6-12(10)19-18-20-17(23)15(27-18)9-11-7-13(21(24)25)16(22)14(8-11)26-2/h3-9,22H,1-2H3,(H,19,20,23)/b15-9+