(E)-2-cyano-3-(4-methylsulfanylphenyl)-N-octyl-prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(4-methylsulfanylphenyl)-N-octyl-prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-methylsulfanylphenyl)-N-octyl-prop-2-enamide CAS Name: (E)-2-cyano-3-[4-(methylthio)phenyl]-N-octyl-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-methylsulfanylphenyl)-N-octylprop-2-enamide Traditional Name: (E)-2-cyano-3-[4-(methylthio)phenyl]-N-octyl-acrylamide Formula: C19H26N2OS MolecularWeight: 330.48754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C(=CC1=CC=C(C=C1)SC)C#N

Isomeric SMILES

CCCCCCCCNC(=O)/C(=C/C1=CC=C(C=C1)SC)/C#N

InChI

InChI=1S/C19H26N2OS/c1-3-4-5-6-7-8-13-21-19(22)17(15-20)14-16-9-11-18(23-2)12-10-16/h9-12,14H,3-8,13H2,1-2H3,(H,21,22)/b17-14+