(E)-N-[2-(2-pyridin-2-ylsulfanylnaphthalen-1-yl)ethyl]but-2-enamide

Systemtic Name: (E)-N-[2-(2-pyridin-2-ylsulfanylnaphthalen-1-yl)ethyl]but-2-enamide Openeye Name: (E)-N-[2-[2-(2-pyridylsulfanyl)-1-naphthyl]ethyl]but-2-enamide CAS Name: (E)-N-[2-[2-(2-pyridinylthio)-1-naphthalenyl]ethyl]-2-butenamide IUPAC Name: (E)-N-[2-(2-pyridin-2-ylsulfanylnaphthalen-1-yl)ethyl]but-2-enamide Traditional Name: (E)-N-[2-[2-(2-pyridylthio)-1-naphthyl]ethyl]but-2-enamide Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NCCC1=C(C=CC2=CC=CC=C21)SC3=CC=CC=N3

Isomeric SMILES

C/C=C/C(=O)NCCC1=C(C=CC2=CC=CC=C21)SC3=CC=CC=N3

InChI

InChI=1S/C21H20N2OS/c1-2-7-20(24)22-15-13-18-17-9-4-3-8-16(17)11-12-19(18)25-21-10-5-6-14-23-21/h2-12,14H,13,15H2,1H3,(H,22,24)/b7-2+