N-[bis(azanyl)methylidene]-2-fluoranyl-4-imidazol-1-yl-5-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-fluoranyl-4-imidazol-1-yl-5-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-2-fluoro-4-imidazol-1-yl-5-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-2-fluoro-4-(1-imidazolyl)-5-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-2-fluoro-4-imidazol-1-yl-5-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-2-fluoro-4-imidazol-1-yl-5-mesyl-benzamide Formula: C12H12FN5O3S MolecularWeight: 325.318783

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)N=C(N)N)F)N2C=CN=C2

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)N=C(N)N)F)N2C=CN=C2

InChI

InChI=1S/C12H12FN5O3S/c1-22(20,21)10-4-7(11(19)17-12(14)15)8(13)5-9(10)18-3-2-16-6-18/h2-6H,1H3,(H4,14,15,17,19)