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

Systemtic Name: 4-[5-phenethylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-(4-benzyl-5-phenethylsulfanyl-1,2,4-triazol-3-yl)pyridine CAS Name: 4-[5-(phenethylthio)-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-(4-benzyl-5-phenethylsulfanyl-1,2,4-triazol-3-yl)pyridine Traditional Name: 4-[4-benzyl-5-(phenethylthio)-1,2,4-triazol-3-yl]pyridine Formula: C22H20N4S MolecularWeight: 372.486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C22H20N4S/c1-3-7-18(8-4-1)13-16-27-22-25-24-21(20-11-14-23-15-12-20)26(22)17-19-9-5-2-6-10-19/h1-12,14-15H,13,16-17H2