2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-ethynylphenyl)ethanamide

Systemtic Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-ethynylphenyl)ethanamide Openeye Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-ethynylphenyl)acetamide CAS Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-(3-ethynylphenyl)acetamide IUPAC Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-ethynylphenyl)acetamide Traditional Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-(3-ethynylphenyl)acetamide Formula: C24H18N4OS MolecularWeight: 410.49092

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H18N4OS/c1-2-18-10-9-13-20(16-18)25-22(29)17-30-24-27-26-23(19-11-5-3-6-12-19)28(24)21-14-7-4-8-15-21/h1,3-16H,17H2,(H,25,29)