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

Systemtic Name: 2-[[4-(2,4-dimethylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[4-(2,4-dimethylphenyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[4-(2,4-dimethylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[4-(2,4-dimethylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[4-(2,4-dimethylphenyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-acetamide Formula: C22H20N4OS2 MolecularWeight: 420.5504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=CC=C3)C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=CC=C3)C4=CC=CS4)C

InChI

InChI=1S/C22H20N4OS2/c1-15-10-11-18(16(2)13-15)26-21(19-9-6-12-28-19)24-25-22(26)29-14-20(27)23-17-7-4-3-5-8-17/h3-13H,14H2,1-2H3,(H,23,27)