N-[2-(pentylamino)ethyl]-2-phenanthren-9-ylsulfanyl-ethanamide

Systemtic Name: N-[2-(pentylamino)ethyl]-2-phenanthren-9-ylsulfanyl-ethanamide Openeye Name: N-[2-(pentylamino)ethyl]-2-(9-phenanthrylsulfanyl)acetamide CAS Name: N-[2-(pentylamino)ethyl]-2-(9-phenanthrenylthio)acetamide IUPAC Name: N-[2-(pentylamino)ethyl]-2-phenanthren-9-ylsulfanylacetamide Traditional Name: N-[2-(amylamino)ethyl]-2-(9-phenanthrylthio)acetamide Formula: C23H28N2OS MolecularWeight: 380.54622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCCNC(=O)CSC1=CC2=CC=CC=C2C3=CC=CC=C31

Isomeric SMILES

CCCCCNCCNC(=O)CSC1=CC2=CC=CC=C2C3=CC=CC=C31

InChI

InChI=1S/C23H28N2OS/c1-2-3-8-13-24-14-15-25-23(26)17-27-22-16-18-9-4-5-10-19(18)20-11-6-7-12-21(20)22/h4-7,9-12,16,24H,2-3,8,13-15,17H2,1H3,(H,25,26)