N-[bis(azanyl)methylidene]-2-chloranyl-5-methylsulfonyl-4-(6-oxidanylidene-1H-pyridazin-3-yl)benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-chloranyl-5-methylsulfonyl-4-(6-oxidanylidene-1H-pyridazin-3-yl)benzamide Openeye Name: 2-chloro-N-(diaminomethylene)-5-methylsulfonyl-4-(6-oxo-1H-pyridazin-3-yl)benzamide CAS Name: 2-chloro-N-(diaminomethylidene)-5-methylsulfonyl-4-(6-oxo-1H-pyridazin-3-yl)benzamide IUPAC Name: 2-chloro-N-(diaminomethylidene)-5-methylsulfonyl-4-(6-oxo-1H-pyridazin-3-yl)benzamide Traditional Name: 2-chloro-N-(diaminomethylene)-4-(6-keto-1H-pyridazin-3-yl)-5-mesyl-benzamide Formula: C13H12ClN5O4S MolecularWeight: 369.78348

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1C2=NNC(=O)C=C2)Cl)C(=O)N=C(N)N

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1C2=NNC(=O)C=C2)Cl)C(=O)N=C(N)N

InChI

InChI=1S/C13H12ClN5O4S/c1-24(22,23)10-5-6(12(21)17-13(15)16)8(14)4-7(10)9-2-3-11(20)19-18-9/h2-5H,1H3,(H,19,20)(H4,15,16,17,21)