N-(4-bromophenyl)-2-[[5-(diphenylmethyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[[5-(diphenylmethyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[(5-benzhydryl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-bromophenyl)acetamide CAS Name: N-(4-bromophenyl)-2-[[5-(diphenylmethyl)-4-ethyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[(5-benzhydryl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-bromophenyl)acetamide Traditional Name: 2-[(5-benzhydryl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-(4-bromophenyl)acetamide Formula: C25H23BrN4OS MolecularWeight: 507.44532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)Br)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)Br)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H23BrN4OS/c1-2-30-24(23(18-9-5-3-6-10-18)19-11-7-4-8-12-19)28-29-25(30)32-17-22(31)27-21-15-13-20(26)14-16-21/h3-16,23H,2,17H2,1H3,(H,27,31)