2-[[5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-ynyl-ethanamide

Systemtic Name: 2-[[5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-ynyl-ethanamide Openeye Name: 2-[[5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-ynyl-acetamide CAS Name: 2-[[5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-prop-2-ynylacetamide IUPAC Name: 2-[[5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-ynylacetamide Traditional Name: 2-[[5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-propargyl-acetamide Formula: C19H14Cl2N4OS MolecularWeight: 417.31166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C#CCNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H14Cl2N4OS/c1-2-10-22-17(26)12-27-19-24-23-18(15-9-8-13(20)11-16(15)21)25(19)14-6-4-3-5-7-14/h1,3-9,11H,10,12H2,(H,22,26)