3-(3-chloranylprop-2-enylsulfanyl)-5-(4-chlorophenyl)-4-(4-phenoxyphenyl)-1,2,4-triazole

Systemtic Name: 3-(3-chloranylprop-2-enylsulfanyl)-5-(4-chlorophenyl)-4-(4-phenoxyphenyl)-1,2,4-triazole Openeye Name: 3-(3-chloroallylsulfanyl)-5-(4-chlorophenyl)-4-(4-phenoxyphenyl)-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-5-(3-chloroprop-2-enylthio)-4-(4-phenoxyphenyl)-1,2,4-triazole IUPAC Name: 3-(4-chlorophenyl)-5-(3-chloroprop-2-enylsulfanyl)-4-(4-phenoxyphenyl)-1,2,4-triazole Traditional Name: 3-(3-chloroallylthio)-5-(4-chlorophenyl)-4-(4-phenoxyphenyl)-1,2,4-triazole Formula: C23H17Cl2N3OS MolecularWeight: 454.37158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=NN=C3SCC=CCl)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=NN=C3SCC=CCl)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H17Cl2N3OS/c24-15-4-16-30-23-27-26-22(17-7-9-18(25)10-8-17)28(23)19-11-13-21(14-12-19)29-20-5-2-1-3-6-20/h1-15H,16H2