N-[bis(azanyl)methylidene]-4-(2-phenylethynyl)-3-(trifluoromethyl)benzamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-4-(2-phenylethynyl)-3-(trifluoromethyl)benzamide hydrochloride Openeye Name: N-(diaminomethylene)-4-(2-phenylethynyl)-3-(trifluoromethyl)benzamide hydrochloride CAS Name: N-(diaminomethylidene)-4-(2-phenylethynyl)-3-(trifluoromethyl)benzamide hydrochloride IUPAC Name: N-(diaminomethylidene)-4-(2-phenylethynyl)-3-(trifluoromethyl)benzamide hydrochloride Traditional Name: N-(diaminomethylene)-4-(2-phenylethynyl)-3-(trifluoromethyl)benzamide hydrochloride Formula: C17H13ClF3N3O MolecularWeight: 367.75283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=C(C=C(C=C2)C(=O)N=C(N)N)C(F)(F)F.Cl

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=C(C=C(C=C2)C(=O)N=C(N)N)C(F)(F)F.Cl

InChI

InChI=1S/C17H12F3N3O.ClH/c18-17(19,20)14-10-13(15(24)23-16(21)22)9-8-12(14)7-6-11-4-2-1-3-5-11;/h1-5,8-10H,(H4,21,22,23,24);1H