3-[2-[(2-ethanoyl-3-oxidanylidene-but-1-enyl)amino]phenyl]sulfanylpropanenitrile

Systemtic Name: 3-[2-[(2-ethanoyl-3-oxidanylidene-but-1-enyl)amino]phenyl]sulfanylpropanenitrile Openeye Name: 3-[2-[(2-acetyl-3-oxo-but-1-enyl)amino]phenyl]sulfanylpropanenitrile CAS Name: 3-[[2-[(2-acetyl-3-oxobut-1-enyl)amino]phenyl]thio]propanenitrile IUPAC Name: 3-[2-[(2-acetyl-3-oxobut-1-enyl)amino]phenyl]sulfanylpropanenitrile Traditional Name: 3-[[2-[(2-acetyl-3-keto-but-1-enyl)amino]phenyl]thio]propionitrile Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CNC1=CC=CC=C1SCCC#N)C(=O)C

Isomeric SMILES

CC(=O)C(=CNC1=CC=CC=C1SCCC#N)C(=O)C

InChI

InChI=1S/C15H16N2O2S/c1-11(18)13(12(2)19)10-17-14-6-3-4-7-15(14)20-9-5-8-16/h3-4,6-7,10,17H,5,9H2,1-2H3