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

Systemtic Name: N-[2-[6,6-dimethylhepta-2,4-diynyl(propyl)amino]ethyl]-2-naphthalen-1-ylsulfanyl-ethanamide Openeye Name: N-[2-[6,6-dimethylhepta-2,4-diynyl(propyl)amino]ethyl]-2-(1-naphthylsulfanyl)acetamide CAS Name: N-[2-[6,6-dimethylhepta-2,4-diynyl(propyl)amino]ethyl]-2-(1-naphthalenylthio)acetamide IUPAC Name: N-[2-[6,6-dimethylhepta-2,4-diynyl(propyl)amino]ethyl]-2-naphthalen-1-ylsulfanylacetamide Traditional Name: N-[2-[6,6-dimethylhepta-2,4-diynyl(propyl)amino]ethyl]-2-(1-naphthylthio)acetamide Formula: C26H32N2OS MolecularWeight: 420.61008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32N2OS/c1-5-18-28(19-10-6-9-16-26(2,3)4)20-17-27-25(29)21-30-24-15-11-13-22-12-7-8-14-23(22)24/h7-8,11-15H,5,17-21H2,1-4H3,(H,27,29)