ethyl 5-cyano-2-[(E)-2-[(4-methylphenyl)amino]ethenyl]-6-methylsulfanyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-[(E)-2-[(4-methylphenyl)amino]ethenyl]-6-methylsulfanyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-[(E)-2-(4-methylanilino)vinyl]-6-methylsulfanyl-pyridine-3-carboxylate CAS Name: 5-cyano-2-[(E)-2-(4-methylanilino)ethenyl]-6-(methylthio)-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-[(E)-2-(4-methylanilino)ethenyl]-6-methylsulfanylpyridine-3-carboxylate Traditional Name: 5-cyano-6-(methylthio)-2-[(E)-2-(p-toluidino)vinyl]nicotinic acid ethyl ester Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SC)C=CNC2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SC)/C=C/NC2=CC=C(C=C2)C

InChI

InChI=1S/C19H19N3O2S/c1-4-24-19(23)16-11-14(12-20)18(25-3)22-17(16)9-10-21-15-7-5-13(2)6-8-15/h5-11,21H,4H2,1-3H3/b10-9+