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

Systemtic Name: 4-[5-[(2-methylphenyl)methylsulfanyl]-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-benzyl-5-(o-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(2-methylphenyl)methylthio]-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-benzyl-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[4-benzyl-5-[(2-methylbenzyl)thio]-1,2,4-triazol-3-yl]pyridine Formula: C22H20N4S MolecularWeight: 372.486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C22H20N4S/c1-17-7-5-6-10-20(17)16-27-22-25-24-21(19-11-13-23-14-12-19)26(22)15-18-8-3-2-4-9-18/h2-14H,15-16H2,1H3