N,N-dimethyl-3-[4-(3-methylbutylsulfanyl)phenyl]propan-1-amine

Systemtic Name: N,N-dimethyl-3-[4-(3-methylbutylsulfanyl)phenyl]propan-1-amine Openeye Name: 3-(4-isopentylsulfanylphenyl)-N,N-dimethyl-propan-1-amine CAS Name: N,N-dimethyl-3-[4-(3-methylbutylthio)phenyl]-1-propanamine IUPAC Name: N,N-dimethyl-3-[4-(3-methylbutylsulfanyl)phenyl]propan-1-amine Traditional Name: 3-[4-(isoamylthio)phenyl]propyl-dimethyl-amine Formula: C16H27NS MolecularWeight: 265.45728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=CC=C(C=C1)CCCN(C)C

Isomeric SMILES

CC(C)CCSC1=CC=C(C=C1)CCCN(C)C

InChI

InChI=1S/C16H27NS/c1-14(2)11-13-18-16-9-7-15(8-10-16)6-5-12-17(3)4/h7-10,14H,5-6,11-13H2,1-4H3