N-[bis(azanyl)methylidene]-3-(trifluoromethyl)benzamide; methanesulfonic acid

Systemtic Name: N-[bis(azanyl)methylidene]-3-(trifluoromethyl)benzamide; methanesulfonic acid Openeye Name: N-(diaminomethylene)-3-(trifluoromethyl)benzamide; methanesulfonic acid CAS Name: N-(diaminomethylidene)-3-(trifluoromethyl)benzamide; methanesulfonic acid IUPAC Name: N-(diaminomethylidene)-3-(trifluoromethyl)benzamide; methanesulfonic acid Traditional Name: N-(diaminomethylene)-3-(trifluoromethyl)benzamide; mesylic acid Formula: C10H12F3N3O4S MolecularWeight: 327.28019

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1=CC(=CC(=C1)C(F)(F)F)C(=O)N=C(N)N

Isomeric SMILES

CS(=O)(=O)O.C1=CC(=CC(=C1)C(F)(F)F)C(=O)N=C(N)N

InChI

InChI=1S/C9H8F3N3O.CH4O3S/c10-9(11,12)6-3-1-2-5(4-6)7(16)15-8(13)14;1-5(2,3)4/h1-4H,(H4,13,14,15,16);1H3,(H,2,3,4)