ethyl 2-cyano-2-(2-ethanoyl-3-oxidanylidene-1-phenylazanyl-but-1-enyl)sulfanyl-ethanoate

Systemtic Name: ethyl 2-cyano-2-(2-ethanoyl-3-oxidanylidene-1-phenylazanyl-but-1-enyl)sulfanyl-ethanoate Openeye Name: ethyl 2-(2-acetyl-1-anilino-3-oxo-but-1-enyl)sulfanyl-2-cyano-acetate CAS Name: 2-[(2-acetyl-1-anilino-3-oxobut-1-enyl)thio]-2-cyanoacetic acid ethyl ester IUPAC Name: ethyl 2-(2-acetyl-1-anilino-3-oxobut-1-enyl)sulfanyl-2-cyanoacetate Traditional Name: 2-[(2-acetyl-1-anilino-3-keto-but-1-enyl)thio]-2-cyano-acetic acid ethyl ester Formula: C17H18N2O4S MolecularWeight: 346.40082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)SC(=C(C(=O)C)C(=O)C)NC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)C(C#N)SC(=C(C(=O)C)C(=O)C)NC1=CC=CC=C1

InChI

InChI=1S/C17H18N2O4S/c1-4-23-17(22)14(10-18)24-16(15(11(2)20)12(3)21)19-13-8-6-5-7-9-13/h5-9,14,19H,4H2,1-3H3