4-[5-[3-(4-chloranylphenoxy)propylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[5-[3-(4-chloranylphenoxy)propylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[3-(4-chlorophenoxy)propylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[3-(4-chlorophenoxy)propylthio]-4-phenyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[3-(4-chlorophenoxy)propylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[3-(4-chlorophenoxy)propylthio]-4-phenyl-1,2,4-triazol-3-yl]pyridine Formula: C22H19ClN4OS MolecularWeight: 422.93046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCCCOC3=CC=C(C=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCCCOC3=CC=C(C=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C22H19ClN4OS/c23-18-7-9-20(10-8-18)28-15-4-16-29-22-26-25-21(17-11-13-24-14-12-17)27(22)19-5-2-1-3-6-19/h1-3,5-14H,4,15-16H2