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

Systemtic Name: 2-[3-(4-bromophenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(4-chlorophenyl)ethanamide Openeye Name: 2-[3-(4-bromophenyl)-4-phenyl-5-thioxo-1,2,4-triazol-1-yl]-N-(4-chlorophenyl)acetamide CAS Name: 2-[3-(4-bromophenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(4-chlorophenyl)acetamide IUPAC Name: 2-[3-(4-bromophenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(4-chlorophenyl)acetamide Traditional Name: 2-[3-(4-bromophenyl)-4-phenyl-5-thioxo-1,2,4-triazol-1-yl]-N-(4-chlorophenyl)acetamide Formula: C22H16BrClN4OS MolecularWeight: 499.81064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN(C2=S)CC(=O)NC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN(C2=S)CC(=O)NC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H16BrClN4OS/c23-16-8-6-15(7-9-16)21-26-27(22(30)28(21)19-4-2-1-3-5-19)14-20(29)25-18-12-10-17(24)11-13-18/h1-13H,14H2,(H,25,29)