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

Systemtic Name: 4-[5-(naphthalen-1-ylmethylsulfanyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-benzyl-5-(1-naphthylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-(1-naphthalenylmethylthio)-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-benzyl-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[4-benzyl-5-(1-naphthylmethylthio)-1,2,4-triazol-3-yl]pyridine Formula: C25H20N4S MolecularWeight: 408.5181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC=NC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC=NC=C5

InChI

InChI=1S/C25H20N4S/c1-2-7-19(8-3-1)17-29-24(21-13-15-26-16-14-21)27-28-25(29)30-18-22-11-6-10-20-9-4-5-12-23(20)22/h1-16H,17-18H2