2-[2-[[5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine

Systemtic Name: 2-[2-[[5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine Openeye Name: 2-[2-[[5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine CAS Name: 2-[2-[[5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]thio]ethyl]pyridine IUPAC Name: 2-[2-[[5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine Traditional Name: 2-[2-[[5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]thio]ethyl]pyridine Formula: C24H24N4OS MolecularWeight: 416.53856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2CCC3=CC=CC=C3)SCCC4=CC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2CCC3=CC=CC=C3)SCCC4=CC=CC=N4

InChI

InChI=1S/C24H24N4OS/c1-29-22-12-10-20(11-13-22)23-26-27-24(30-18-15-21-9-5-6-16-25-21)28(23)17-14-19-7-3-2-4-8-19/h2-13,16H,14-15,17-18H2,1H3