3-(2-fluorophenyl)-4-(phenylmethyl)-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(2-fluorophenyl)-4-(phenylmethyl)-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 4-benzyl-3-benzylsulfanyl-5-(2-fluorophenyl)-1,2,4-triazole CAS Name: 3-(2-fluorophenyl)-4-(phenylmethyl)-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 4-benzyl-3-benzylsulfanyl-5-(2-fluorophenyl)-1,2,4-triazole Traditional Name: 4-benzyl-3-(benzylthio)-5-(2-fluorophenyl)-1,2,4-triazole Formula: C22H18FN3S MolecularWeight: 375.461823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=C2SCC3=CC=CC=C3)C4=CC=CC=C4F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=C2SCC3=CC=CC=C3)C4=CC=CC=C4F

InChI

InChI=1S/C22H18FN3S/c23-20-14-8-7-13-19(20)21-24-25-22(27-16-18-11-5-2-6-12-18)26(21)15-17-9-3-1-4-10-17/h1-14H,15-16H2