N-[2-[butyl(6,6-dimethylhepta-2,4-diynyl)amino]ethyl]-2-naphthalen-1-ylsulfanyl-ethanamide

Systemtic Name: N-[2-[butyl(6,6-dimethylhepta-2,4-diynyl)amino]ethyl]-2-naphthalen-1-ylsulfanyl-ethanamide Openeye Name: N-[2-[butyl(6,6-dimethylhepta-2,4-diynyl)amino]ethyl]-2-(1-naphthylsulfanyl)acetamide CAS Name: N-[2-[butyl(6,6-dimethylhepta-2,4-diynyl)amino]ethyl]-2-(1-naphthalenylthio)acetamide IUPAC Name: N-[2-[butyl(6,6-dimethylhepta-2,4-diynyl)amino]ethyl]-2-naphthalen-1-ylsulfanylacetamide Traditional Name: N-[2-[butyl(6,6-dimethylhepta-2,4-diynyl)amino]ethyl]-2-(1-naphthylthio)acetamide Formula: C27H34N2OS MolecularWeight: 434.63666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCNC(=O)CSC1=CC=CC2=CC=CC=C21)CC#CC#CC(C)(C)C

Isomeric SMILES

CCCCN(CCNC(=O)CSC1=CC=CC2=CC=CC=C21)CC#CC#CC(C)(C)C

InChI

InChI=1S/C27H34N2OS/c1-5-6-19-29(20-11-7-10-17-27(2,3)4)21-18-28-26(30)22-31-25-16-12-14-23-13-8-9-15-24(23)25/h8-9,12-16H,5-6,18-22H2,1-4H3,(H,28,30)