2-[3-(2-bromophenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[3-(2-bromophenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[3-(2-bromophenyl)-4-phenyl-5-thioxo-1,2,4-triazol-1-yl]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[3-(2-bromophenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[3-(2-bromophenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[3-(2-bromophenyl)-4-phenyl-5-thioxo-1,2,4-triazol-1-yl]-N-(2,6-dimethylphenyl)acetamide Formula: C24H21BrN4OS MolecularWeight: 493.41874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2C(=S)N(C(=N2)C3=CC=CC=C3Br)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2C(=S)N(C(=N2)C3=CC=CC=C3Br)C4=CC=CC=C4

InChI

InChI=1S/C24H21BrN4OS/c1-16-9-8-10-17(2)22(16)26-21(30)15-28-24(31)29(18-11-4-3-5-12-18)23(27-28)19-13-6-7-14-20(19)25/h3-14H,15H2,1-2H3,(H,26,30)