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

Systemtic Name: (E)-5-(phenethylamino)-N-(1,3,4-thiadiazol-2-yl)octadec-9-enamide Openeye Name: (E)-5-(phenethylamino)-N-(1,3,4-thiadiazol-2-yl)octadec-9-enamide CAS Name: (E)-5-(phenethylamino)-N-(1,3,4-thiadiazol-2-yl)-9-octadecenamide IUPAC Name: (E)-5-(phenethylamino)-N-(1,3,4-thiadiazol-2-yl)octadec-9-enamide Traditional Name: (E)-5-(phenethylamino)-N-(1,3,4-thiadiazol-2-yl)octadec-9-enamide Formula: C28H44N4OS MolecularWeight: 484.74016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCC(CCCC(=O)NC1=NN=CS1)NCCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCC/C=C/CCCC(CCCC(=O)NC1=NN=CS1)NCCC2=CC=CC=C2

InChI

InChI=1S/C28H44N4OS/c1-2-3-4-5-6-7-8-9-10-11-15-19-26(29-23-22-25-17-13-12-14-18-25)20-16-21-27(33)31-28-32-30-24-34-28/h9-10,12-14,17-18,24,26,29H,2-8,11,15-16,19-23H2,1H3,(H,31,32,33)/b10-9+