2-[[(E)-2-cyano-1-(3-nitrophenyl)ethenyl]-methyl-amino]-N-(2-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[[(E)-2-cyano-1-(3-nitrophenyl)ethenyl]-methyl-amino]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: 2-[[(E)-2-cyano-1-(3-nitrophenyl)vinyl]-methyl-amino]-N-(2-methylsulfanylphenyl)acetamide CAS Name: 2-[[(E)-2-cyano-1-(3-nitrophenyl)ethenyl]-methylamino]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[[(E)-2-cyano-1-(3-nitrophenyl)ethenyl]-methylamino]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: 2-[[(E)-2-cyano-1-(3-nitrophenyl)vinyl]-methyl-amino]-N-[2-(methylthio)phenyl]acetamide Formula: C19H18N4O3S MolecularWeight: 382.43622

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1SC)C(=CC#N)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1SC)/C(=C/C#N)/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O3S/c1-22(13-19(24)21-16-8-3-4-9-18(16)27-2)17(10-11-20)14-6-5-7-15(12-14)23(25)26/h3-10,12H,13H2,1-2H3,(H,21,24)/b17-10+