N-[bis(azanyl)methylidene]-4-(2,4-dimethylimidazol-1-yl)-5-methylsulfonyl-2-nitro-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-(2,4-dimethylimidazol-1-yl)-5-methylsulfonyl-2-nitro-benzamide Openeye Name: N-(diaminomethylene)-4-(2,4-dimethylimidazol-1-yl)-5-methylsulfonyl-2-nitro-benzamide CAS Name: N-(diaminomethylidene)-4-(2,4-dimethyl-1-imidazolyl)-5-methylsulfonyl-2-nitrobenzamide IUPAC Name: N-(diaminomethylidene)-4-(2,4-dimethylimidazol-1-yl)-5-methylsulfonyl-2-nitrobenzamide Traditional Name: N-(diaminomethylene)-4-(2,4-dimethylimidazol-1-yl)-5-mesyl-2-nitro-benzamide Formula: C14H16N6O5S MolecularWeight: 380.37904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=N1)C)C2=C(C=C(C(=C2)[N+](=O)[O-])C(=O)N=C(N)N)S(=O)(=O)C

Isomeric SMILES

CC1=CN(C(=N1)C)C2=C(C=C(C(=C2)[N+](=O)[O-])C(=O)N=C(N)N)S(=O)(=O)C

InChI

InChI=1S/C14H16N6O5S/c1-7-6-19(8(2)17-7)11-5-10(20(22)23)9(13(21)18-14(15)16)4-12(11)26(3,24)25/h4-6H,1-3H3,(H4,15,16,18,21)