(E)-2-cyano-3-methylsulfanyl-3-(phenethylamino)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-methylsulfanyl-3-(phenethylamino)prop-2-enamide Openeye Name: (E)-2-cyano-3-methylsulfanyl-3-(phenethylamino)prop-2-enamide CAS Name: (E)-2-cyano-3-(methylthio)-3-(phenethylamino)-2-propenamide IUPAC Name: (E)-2-cyano-3-methylsulfanyl-3-(phenethylamino)prop-2-enamide Traditional Name: (E)-2-cyano-3-(methylthio)-3-(phenethylamino)acrylamide Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C#N)C(=O)N)NCCC1=CC=CC=C1

Isomeric SMILES

CS/C(=C(\C#N)/C(=O)N)/NCCC1=CC=CC=C1

InChI

InChI=1S/C13H15N3OS/c1-18-13(11(9-14)12(15)17)16-8-7-10-5-3-2-4-6-10/h2-6,16H,7-8H2,1H3,(H2,15,17)/b13-11+