N-[1-[4-[2,5-bis(chloranyl)phenyl]-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]-2-phenyl-ethanamide

Systemtic Name: N-[1-[4-[2,5-bis(chloranyl)phenyl]-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]-2-phenyl-ethanamide Openeye Name: N-[1-[5-benzylsulfanyl-4-(2,5-dichlorophenyl)-1,2,4-triazol-3-yl]ethyl]-2-phenyl-acetamide CAS Name: N-[1-[4-(2,5-dichlorophenyl)-5-(phenylmethylthio)-1,2,4-triazol-3-yl]ethyl]-2-phenylacetamide IUPAC Name: N-[1-[5-benzylsulfanyl-4-(2,5-dichlorophenyl)-1,2,4-triazol-3-yl]ethyl]-2-phenylacetamide Traditional Name: N-[1-[5-(benzylthio)-4-(2,5-dichlorophenyl)-1,2,4-triazol-3-yl]ethyl]-2-phenyl-acetamide Formula: C25H22Cl2N4OS MolecularWeight: 497.43938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(N1C2=C(C=CC(=C2)Cl)Cl)SCC3=CC=CC=C3)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C1=NN=C(N1C2=C(C=CC(=C2)Cl)Cl)SCC3=CC=CC=C3)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H22Cl2N4OS/c1-17(28-23(32)14-18-8-4-2-5-9-18)24-29-30-25(33-16-19-10-6-3-7-11-19)31(24)22-15-20(26)12-13-21(22)27/h2-13,15,17H,14,16H2,1H3,(H,28,32)