ethyl (E)-3-[(4-methylsulfanylphenyl)amino]but-2-enoate

Systemtic Name: ethyl (E)-3-[(4-methylsulfanylphenyl)amino]but-2-enoate Openeye Name: ethyl (E)-3-(4-methylsulfanylanilino)but-2-enoate CAS Name: (E)-3-[4-(methylthio)anilino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(4-methylsulfanylanilino)but-2-enoate Traditional Name: (E)-3-[4-(methylthio)anilino]but-2-enoic acid ethyl ester Formula: C13H17NO2S MolecularWeight: 251.34458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC1=CC=C(C=C1)SC

InChI

InChI=1S/C13H17NO2S/c1-4-16-13(15)9-10(2)14-11-5-7-12(17-3)8-6-11/h5-9,14H,4H2,1-3H3/b10-9+