3-(2-methylphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-(2-methylphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-(1-naphthylmethylsulfanyl)-5-(o-tolyl)-1,2,4-triazole CAS Name: 3-(2-methylphenyl)-5-(1-naphthalenylmethylthio)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-(2-methylphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-(1-naphthylmethylthio)-5-(o-tolyl)-1,2,4-triazole Formula: C23H21N3S MolecularWeight: 371.49794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2CC=C)SCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2CC=C)SCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H21N3S/c1-3-15-26-22(20-13-6-4-9-17(20)2)24-25-23(26)27-16-19-12-8-11-18-10-5-7-14-21(18)19/h3-14H,1,15-16H2,2H3