pyrrolidin-1-yl-[4-(16-sulfanylhexadecylamino)phenyl]methanone

Systemtic Name: pyrrolidin-1-yl-[4-(16-sulfanylhexadecylamino)phenyl]methanone Openeye Name: pyrrolidin-1-yl-[4-(16-sulfanylhexadecylamino)phenyl]methanone CAS Name: [4-(16-mercaptohexadecylamino)phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: pyrrolidin-1-yl-[4-(16-sulfanylhexadecylamino)phenyl]methanone Traditional Name: [4-(16-mercaptohexadecylamino)phenyl]-pyrrolidino-methanone Formula: C27H46N2OS MolecularWeight: 446.73194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)NCCCCCCCCCCCCCCCCS

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)NCCCCCCCCCCCCCCCCS

InChI

InChI=1S/C27H46N2OS/c30-27(29-22-14-15-23-29)25-17-19-26(20-18-25)28-21-13-11-9-7-5-3-1-2-4-6-8-10-12-16-24-31/h17-20,28,31H,1-16,21-24H2