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

Systemtic Name: 3-[5-[(4-methylsulfanylphenyl)methylsulfanyl]-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[4-benzyl-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[5-[[4-(methylthio)phenyl]methylthio]-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[4-benzyl-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[4-benzyl-5-[[4-(methylthio)benzyl]thio]-1,2,4-triazol-3-yl]pyridine Formula: C22H20N4S2 MolecularWeight: 404.551

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C22H20N4S2/c1-27-20-11-9-18(10-12-20)16-28-22-25-24-21(19-8-5-13-23-14-19)26(22)15-17-6-3-2-4-7-17/h2-14H,15-16H2,1H3