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

Systemtic Name: (E)-N-[5-(4-phenylbutylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide Openeye Name: (E)-N-[5-(4-phenylbutylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide CAS Name: (E)-N-[5-(4-phenylbutylamino)-1,3,4-thiadiazol-2-yl]-9-octadecenamide IUPAC Name: (E)-N-[5-(4-phenylbutylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide Traditional Name: (E)-N-[5-(4-phenylbutylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide Formula: C30H48N4OS MolecularWeight: 512.79332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NC1=NN=C(S1)NCCCCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NC1=NN=C(S1)NCCCCC2=CC=CC=C2

InChI

InChI=1S/C30H48N4OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-25-28(35)32-30-34-33-29(36-30)31-26-21-20-24-27-22-17-16-18-23-27/h9-10,16-18,22-23H,2-8,11-15,19-21,24-26H2,1H3,(H,31,33)(H,32,34,35)/b10-9+