N-(4-chlorophenyl)-2-[[5-[[(2,5-dimethylphenyl)amino]methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-chlorophenyl)-2-[[5-[[(2,5-dimethylphenyl)amino]methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-chlorophenyl)-2-[[5-[(2,5-dimethylanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-chlorophenyl)-2-[[5-[(2,5-dimethylanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-chlorophenyl)-2-[[5-[(2,5-dimethylanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-chlorophenyl)-2-[[5-[(2,5-dimethylanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C25H24ClN5OS MolecularWeight: 478.00896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H24ClN5OS/c1-17-8-9-18(2)22(14-17)27-15-23-29-30-25(31(23)21-6-4-3-5-7-21)33-16-24(32)28-20-12-10-19(26)11-13-20/h3-14,27H,15-16H2,1-2H3,(H,28,32)