1-(4-chlorophenyl)-N-(3-ethynylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-N-(3-ethynylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 1-(4-chlorophenyl)-N-(3-ethynylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-(4-chlorophenyl)-N-(3-ethynylphenyl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-(4-chlorophenyl)-N-(3-ethynylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: 1-(4-chlorophenyl)-N-(3-ethynylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C19H11ClF3N3O MolecularWeight: 389.75835

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C19H11ClF3N3O/c1-2-12-4-3-5-14(10-12)25-18(27)16-11-24-26(17(16)19(21,22)23)15-8-6-13(20)7-9-15/h1,3-11H,(H,25,27)