N,N-dimethyl-2-[(4-octylsulfanylphenyl)-phenyl-methyl]sulfanyl-ethanamine

Systemtic Name: N,N-dimethyl-2-[(4-octylsulfanylphenyl)-phenyl-methyl]sulfanyl-ethanamine Openeye Name: N,N-dimethyl-2-[(4-octylsulfanylphenyl)-phenyl-methyl]sulfanyl-ethanamine CAS Name: N,N-dimethyl-2-[[[4-(octylthio)phenyl]-phenylmethyl]thio]ethanamine IUPAC Name: N,N-dimethyl-2-[(4-octylsulfanylphenyl)-phenylmethyl]sulfanylethanamine Traditional Name: dimethyl-[2-[[[4-(octylthio)phenyl]-phenyl-methyl]thio]ethyl]amine Formula: C25H37NS2 MolecularWeight: 415.69798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=CC=C(C=C1)C(C2=CC=CC=C2)SCCN(C)C

Isomeric SMILES

CCCCCCCCSC1=CC=C(C=C1)C(C2=CC=CC=C2)SCCN(C)C

InChI

InChI=1S/C25H37NS2/c1-4-5-6-7-8-12-20-27-24-17-15-23(16-18-24)25(28-21-19-26(2)3)22-13-10-9-11-14-22/h9-11,13-18,25H,4-8,12,19-21H2,1-3H3