4-(4-chlorophenyl)-3-methyl-5-prop-2-enylsulfanyl-1,2,4-triazole

Systemtic Name: 4-(4-chlorophenyl)-3-methyl-5-prop-2-enylsulfanyl-1,2,4-triazole Openeye Name: 3-allylsulfanyl-4-(4-chlorophenyl)-5-methyl-1,2,4-triazole CAS Name: 4-(4-chlorophenyl)-3-methyl-5-(prop-2-enylthio)-1,2,4-triazole IUPAC Name: 4-(4-chlorophenyl)-3-methyl-5-prop-2-enylsulfanyl-1,2,4-triazole Traditional Name: 3-(allylthio)-4-(4-chlorophenyl)-5-methyl-1,2,4-triazole Formula: C12H12ClN3S MolecularWeight: 265.76178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=C(C=C2)Cl)SCC=C

Isomeric SMILES

CC1=NN=C(N1C2=CC=C(C=C2)Cl)SCC=C

InChI

InChI=1S/C12H12ClN3S/c1-3-8-17-12-15-14-9(2)16(12)11-6-4-10(13)5-7-11/h3-7H,1,8H2,2H3