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

Systemtic Name: 5-chloranyl-3-methyl-1-phenyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]pyrazole-4-carboxamide Openeye Name: 5-chloro-3-methyl-1-phenyl-N-[3-[2-(2-thienyl)ethynyl]phenyl]pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-phenyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-3-methyl-1-phenyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]pyrazole-4-carboxamide Traditional Name: 5-chloro-3-methyl-1-phenyl-N-[3-[2-(2-thienyl)ethynyl]phenyl]pyrazole-4-carboxamide Formula: C23H16ClN3OS MolecularWeight: 417.91064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H16ClN3OS/c1-16-21(22(24)27(26-16)19-9-3-2-4-10-19)23(28)25-18-8-5-7-17(15-18)12-13-20-11-6-14-29-20/h2-11,14-15H,1H3,(H,25,28)