(E)-N-ethyl-6,6-dimethyl-N-[2-[2-(3-thiophen-3-ylphenoxy)ethylsulfanyl]ethyl]hept-2-en-4-yn-1-amine

Systemtic Name: (E)-N-ethyl-6,6-dimethyl-N-[2-[2-(3-thiophen-3-ylphenoxy)ethylsulfanyl]ethyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-N-ethyl-6,6-dimethyl-N-[2-[2-[3-(3-thienyl)phenoxy]ethylsulfanyl]ethyl]hept-2-en-4-yn-1-amine CAS Name: (E)-N-ethyl-6,6-dimethyl-N-[2-[2-[3-(3-thiophenyl)phenoxy]ethylthio]ethyl]-1-hept-2-en-4-ynamine IUPAC Name: (E)-N-ethyl-6,6-dimethyl-N-[2-[2-(3-thiophen-3-ylphenoxy)ethylsulfanyl]ethyl]hept-2-en-4-yn-1-amine Traditional Name: [(E)-6,6-dimethylhept-2-en-4-ynyl]-ethyl-[2-[2-[3-(3-thienyl)phenoxy]ethylthio]ethyl]amine Formula: C25H33NOS2 MolecularWeight: 427.66562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCSCCOC1=CC=CC(=C1)C2=CSC=C2)CC=CC#CC(C)(C)C

Isomeric SMILES

CCN(CCSCCOC1=CC=CC(=C1)C2=CSC=C2)C/C=C/C#CC(C)(C)C

InChI

InChI=1S/C25H33NOS2/c1-5-26(14-8-6-7-13-25(2,3)4)15-18-28-19-16-27-24-11-9-10-22(20-24)23-12-17-29-21-23/h6,8-12,17,20-21H,5,14-16,18-19H2,1-4H3/b8-6+