2-(4-chloranylbutylsulfanyl)-5-methyl-aniline

Systemtic Name: 2-(4-chloranylbutylsulfanyl)-5-methyl-aniline Openeye Name: 2-(4-chlorobutylsulfanyl)-5-methyl-aniline CAS Name: 2-(4-chlorobutylthio)-5-methylaniline IUPAC Name: 2-(4-chlorobutylsulfanyl)-5-methylaniline Traditional Name: [2-(4-chlorobutylthio)-5-methyl-phenyl]amine Formula: C11H16ClNS MolecularWeight: 229.76944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCCCCCl)N

Isomeric SMILES

CC1=CC(=C(C=C1)SCCCCCl)N

InChI

InChI=1S/C11H16ClNS/c1-9-4-5-11(10(13)8-9)14-7-3-2-6-12/h4-5,8H,2-3,6-7,13H2,1H3