5-methyl-1-phenyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]pyrazole-4-carboxamide

Systemtic Name: 5-methyl-1-phenyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]pyrazole-4-carboxamide Openeye Name: 5-methyl-1-phenyl-N-[3-[2-(2-thienyl)ethynyl]phenyl]pyrazole-4-carboxamide CAS Name: 5-methyl-1-phenyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: 5-methyl-1-phenyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]pyrazole-4-carboxamide Traditional Name: 5-methyl-1-phenyl-N-[3-[2-(2-thienyl)ethynyl]phenyl]pyrazole-4-carboxamide Formula: C23H17N3OS MolecularWeight: 383.46558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

InChI

InChI=1S/C23H17N3OS/c1-17-22(16-24-26(17)20-9-3-2-4-10-20)23(27)25-19-8-5-7-18(15-19)12-13-21-11-6-14-28-21/h2-11,14-16H,1H3,(H,25,27)