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

Systemtic Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-fluoranyl-5-methyl-phenyl)ethanamide Openeye Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-fluoro-5-methyl-phenyl)acetamide CAS Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-(2-fluoro-5-methylphenyl)acetamide IUPAC Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-fluoro-5-methylphenyl)acetamide Traditional Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-(2-fluoro-5-methyl-phenyl)acetamide Formula: C23H19FN4OS MolecularWeight: 418.486563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19FN4OS/c1-16-12-13-19(24)20(14-16)25-21(29)15-30-23-27-26-22(17-8-4-2-5-9-17)28(23)18-10-6-3-7-11-18/h2-14H,15H2,1H3,(H,25,29)