(E)-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide

Systemtic Name: (E)-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide Openeye Name: (E)-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide CAS Name: (E)-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]-9-octadecenamide IUPAC Name: (E)-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide Traditional Name: (E)-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide Formula: C35H50N4OS MolecularWeight: 574.8627

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NC1=NN=C(S1)NCCC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NC1=NN=C(S1)NCCC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C35H50N4OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-27-33(40)37-35-39-38-34(41-35)36-29-28-32(30-23-18-16-19-24-30)31-25-20-17-21-26-31/h9-10,16-21,23-26,32H,2-8,11-15,22,27-29H2,1H3,(H,36,38)(H,37,39,40)/b10-9+