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

Systemtic Name: (5E)-2-[(3-methoxyphenyl)amino]-5-[(5-nitro-2-oxidanyl-phenyl)methylidene]-1,3-thiazol-4-one Openeye Name: (5E)-5-[(2-hydroxy-5-nitro-phenyl)methylene]-2-(3-methoxyanilino)thiazol-4-one CAS Name: (5E)-5-[(2-hydroxy-5-nitrophenyl)methylidene]-2-(3-methoxyanilino)-4-thiazolone IUPAC Name: (5E)-5-[(2-hydroxy-5-nitrophenyl)methylidene]-2-(3-methoxyanilino)-1,3-thiazol-4-one Traditional Name: (5E)-5-(2-hydroxy-5-nitro-benzylidene)-2-(m-anisidino)-2-thiazolin-4-one Formula: C17H13N3O5S MolecularWeight: 371.36722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC(=O)C(=CC3=C(C=CC(=C3)[N+](=O)[O-])O)S2

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC(=O)/C(=C\C3=C(C=CC(=C3)[N+](=O)[O-])O)/S2

InChI

InChI=1S/C17H13N3O5S/c1-25-13-4-2-3-11(9-13)18-17-19-16(22)15(26-17)8-10-7-12(20(23)24)5-6-14(10)21/h2-9,21H,1H3,(H,18,19,22)/b15-8+