4-[[2-(2-cyanoethylsulfanyl)phenyl]amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: 4-[[2-(2-cyanoethylsulfanyl)phenyl]amino]-4-oxidanylidene-but-2-enoate Openeye Name: 4-[2-(2-cyanoethylsulfanyl)anilino]-4-oxo-but-2-enoate CAS Name: 4-[2-(2-cyanoethylthio)anilino]-4-oxo-2-butenoate IUPAC Name: 4-[2-(2-cyanoethylsulfanyl)anilino]-4-oxobut-2-enoate Traditional Name: 4-[2-(2-cyanoethylthio)anilino]-4-keto-but-2-enoate Formula: C13H11N2O3S- MolecularWeight: 275.30304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C=CC(=O)[O-])SCCC#N

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C=CC(=O)[O-])SCCC#N

InChI

InChI=1S/C13H12N2O3S/c14-8-3-9-19-11-5-2-1-4-10(11)15-12(16)6-7-13(17)18/h1-2,4-7H,3,9H2,(H,15,16)(H,17,18)/p-1