N-(3-fluoranyl-4-methyl-phenyl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C18H17FN4OS MolecularWeight: 356.417183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2C(=NNC2=S)C3=CC(=CC=C3)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2C(=NNC2=S)C3=CC(=CC=C3)C)F

InChI

InChI=1S/C18H17FN4OS/c1-11-4-3-5-13(8-11)17-21-22-18(25)23(17)10-16(24)20-14-7-6-12(2)15(19)9-14/h3-9H,10H2,1-2H3,(H,20,24)(H,22,25)