3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-propan-2-yl-1,2,4-triazole

Systemtic Name: 3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-propan-2-yl-1,2,4-triazole Openeye Name: 3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-isopropyl-1,2,4-triazole CAS Name: 3-[2-(4-chlorophenyl)sulfonylethylthio]-4-propan-2-yl-1,2,4-triazole IUPAC Name: 3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-propan-2-yl-1,2,4-triazole Traditional Name: 3-[2-(4-chlorophenyl)sulfonylethylthio]-4-isopropyl-1,2,4-triazole Formula: C13H16ClN3O2S2 MolecularWeight: 345.86804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)N1C=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H16ClN3O2S2/c1-10(2)17-9-15-16-13(17)20-7-8-21(18,19)12-5-3-11(14)4-6-12/h3-6,9-10H,7-8H2,1-2H3