3-[1-(2-chlorophenyl)ethylsulfanyl]-5-cyclohexyl-1,2,4-triazol-4-amine

Systemtic Name: 3-[1-(2-chlorophenyl)ethylsulfanyl]-5-cyclohexyl-1,2,4-triazol-4-amine Openeye Name: 3-[1-(2-chlorophenyl)ethylsulfanyl]-5-cyclohexyl-1,2,4-triazol-4-amine CAS Name: 3-[1-(2-chlorophenyl)ethylthio]-5-cyclohexyl-1,2,4-triazol-4-amine IUPAC Name: 3-[1-(2-chlorophenyl)ethylsulfanyl]-5-cyclohexyl-1,2,4-triazol-4-amine Traditional Name: [3-[1-(2-chlorophenyl)ethylthio]-5-cyclohexyl-1,2,4-triazol-4-yl]amine Formula: C16H21ClN4S MolecularWeight: 336.88274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)SC2=NN=C(N2N)C3CCCCC3

Isomeric SMILES

CC(C1=CC=CC=C1Cl)SC2=NN=C(N2N)C3CCCCC3

InChI

InChI=1S/C16H21ClN4S/c1-11(13-9-5-6-10-14(13)17)22-16-20-19-15(21(16)18)12-7-3-2-4-8-12/h5-6,9-12H,2-4,7-8,18H2,1H3