3-[(5E)-5-[(3-nitrophenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[(5E)-5-[(3-nitrophenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]-2H-phthalazine-1,4-dione Openeye Name: 3-[(5E)-5-[(3-nitrophenyl)methylene]-4-oxo-thiazol-2-yl]-2H-phthalazine-1,4-dione CAS Name: 3-[(5E)-5-[(3-nitrophenyl)methylidene]-4-oxo-2-thiazolyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[(5E)-5-[(3-nitrophenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]-2H-phthalazine-1,4-dione Traditional Name: 3-[(5E)-4-keto-5-(3-nitrobenzylidene)-2-thiazolin-2-yl]-2H-phthalazine-1,4-quinone Formula: C18H10N4O5S MolecularWeight: 394.3608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN(C2=O)C3=NC(=O)C(=CC4=CC(=CC=C4)[N+](=O)[O-])S3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN(C2=O)C3=NC(=O)/C(=C\C4=CC(=CC=C4)[N+](=O)[O-])/S3

InChI

InChI=1S/C18H10N4O5S/c23-15-12-6-1-2-7-13(12)17(25)21(20-15)18-19-16(24)14(28-18)9-10-4-3-5-11(8-10)22(26)27/h1-9H,(H,20,23)/b14-9+