5-[3-(3,5-dimethylphenoxy)propylsulfanyl]pyridin-2-amine

Systemtic Name: 5-[3-(3,5-dimethylphenoxy)propylsulfanyl]pyridin-2-amine Openeye Name: 5-[3-(3,5-dimethylphenoxy)propylsulfanyl]pyridin-2-amine CAS Name: 5-[3-(3,5-dimethylphenoxy)propylthio]-2-pyridinamine IUPAC Name: 5-[3-(3,5-dimethylphenoxy)propylsulfanyl]pyridin-2-amine Traditional Name: [5-[3-(3,5-dimethylphenoxy)propylthio]-2-pyridyl]amine Formula: C16H20N2OS MolecularWeight: 288.4078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCCSC2=CN=C(C=C2)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCCSC2=CN=C(C=C2)N)C

InChI

InChI=1S/C16H20N2OS/c1-12-8-13(2)10-14(9-12)19-6-3-7-20-15-4-5-16(17)18-11-15/h4-5,8-11H,3,6-7H2,1-2H3,(H2,17,18)