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

Systemtic Name: N-[bis(azanyl)methylidene]-4-imidazol-1-yl-5-methylsulfonyl-2-(trifluoromethyl)benzamide Openeye Name: N-(diaminomethylene)-4-imidazol-1-yl-5-methylsulfonyl-2-(trifluoromethyl)benzamide CAS Name: N-(diaminomethylidene)-4-(1-imidazolyl)-5-methylsulfonyl-2-(trifluoromethyl)benzamide IUPAC Name: N-(diaminomethylidene)-4-imidazol-1-yl-5-methylsulfonyl-2-(trifluoromethyl)benzamide Traditional Name: N-(diaminomethylene)-4-imidazol-1-yl-5-mesyl-2-(trifluoromethyl)benzamide Formula: C13H12F3N5O3S MolecularWeight: 375.32629

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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)C(F)(F)F)N2C=CN=C2

Isomeric SMILES

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

InChI

InChI=1S/C13H12F3N5O3S/c1-25(23,24)10-4-7(11(22)20-12(17)18)8(13(14,15)16)5-9(10)21-3-2-19-6-21/h2-6H,1H3,(H4,17,18,20,22)