N-[3-(2-thiophen-2-ylethynyl)phenyl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[3-(2-thiophen-2-ylethynyl)phenyl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[3-[2-(2-thienyl)ethynyl]phenyl]-2H-benzotriazole-5-carboxamide CAS Name: N-[3-(2-thiophen-2-ylethynyl)phenyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[3-(2-thiophen-2-ylethynyl)phenyl]-2H-benzotriazole-5-carboxamide Traditional Name: N-[3-[2-(2-thienyl)ethynyl]phenyl]-2H-benzotriazole-5-carboxamide Formula: C19H12N4OS MolecularWeight: 344.38978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC3=NNN=C3C=C2)C#CC4=CC=CS4

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC3=NNN=C3C=C2)C#CC4=CC=CS4

InChI

InChI=1S/C19H12N4OS/c24-19(14-7-9-17-18(12-14)22-23-21-17)20-15-4-1-3-13(11-15)6-8-16-5-2-10-25-16/h1-5,7,9-12H,(H,20,24)(H,21,22,23)