2-[5-[(4-methoxyphenyl)methylsulfanyl]-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 2-[5-[(4-methoxyphenyl)methylsulfanyl]-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 2-[4-benzyl-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine CAS Name: 2-[5-[(4-methoxyphenyl)methylthio]-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 2-[4-benzyl-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 2-[4-benzyl-5-(p-anisylthio)-1,2,4-triazol-3-yl]pyridine Formula: C22H20N4OS MolecularWeight: 388.4854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CC=N4

InChI

InChI=1S/C22H20N4OS/c1-27-19-12-10-18(11-13-19)16-28-22-25-24-21(20-9-5-6-14-23-20)26(22)15-17-7-3-2-4-8-17/h2-14H,15-16H2,1H3