N-(6-nitro-1,3-benzothiazol-2-yl)-6-oxidanylidene-1H-pyridazine-3-carboxamide

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-6-oxidanylidene-1H-pyridazine-3-carboxamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)-6-oxo-1H-pyridazine-3-carboxamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-6-oxo-1H-pyridazine-3-carboxamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-6-oxo-1H-pyridazine-3-carboxamide Traditional Name: 6-keto-N-(6-nitro-1,3-benzothiazol-2-yl)-1H-pyridazine-3-carboxamide Formula: C12H7N5O4S MolecularWeight: 317.28008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)C3=NNC(=O)C=C3

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)C3=NNC(=O)C=C3

InChI

InChI=1S/C12H7N5O4S/c18-10-4-3-8(15-16-10)11(19)14-12-13-7-2-1-6(17(20)21)5-9(7)22-12/h1-5H,(H,16,18)(H,13,14,19)