2-[3-(3,5-dimethylphenoxy)propylsulfanyl]aniline

Systemtic Name: 2-[3-(3,5-dimethylphenoxy)propylsulfanyl]aniline Openeye Name: 2-[3-(3,5-dimethylphenoxy)propylsulfanyl]aniline CAS Name: 2-[3-(3,5-dimethylphenoxy)propylthio]aniline IUPAC Name: 2-[3-(3,5-dimethylphenoxy)propylsulfanyl]aniline Traditional Name: [2-[3-(3,5-dimethylphenoxy)propylthio]phenyl]amine Formula: C17H21NOS MolecularWeight: 287.41974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCCSC2=CC=CC=C2N)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCCSC2=CC=CC=C2N)C

InChI

InChI=1S/C17H21NOS/c1-13-10-14(2)12-15(11-13)19-8-5-9-20-17-7-4-3-6-16(17)18/h3-4,6-7,10-12H,5,8-9,18H2,1-2H3