ethyl 2-[2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylethanoyl-phenyl-amino]ethanoate

Systemtic Name: ethyl 2-[2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylethanoyl-phenyl-amino]ethanoate Openeye Name: ethyl 2-(N-[2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]acetyl]anilino)acetate CAS Name: 2-(N-[2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-1-oxoethyl]anilino)acetic acid ethyl ester IUPAC Name: ethyl 2-(N-[2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylacetyl]anilino)acetate Traditional Name: 2-(N-[2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]acetyl]anilino)acetic acid ethyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=CC=CC=C1)C(=O)CSC2=C(C(=CC(=N2)C)C)C#N

Isomeric SMILES

CCOC(=O)CN(C1=CC=CC=C1)C(=O)CSC2=C(C(=CC(=N2)C)C)C#N

InChI

InChI=1S/C20H21N3O3S/c1-4-26-19(25)12-23(16-8-6-5-7-9-16)18(24)13-27-20-17(11-21)14(2)10-15(3)22-20/h5-10H,4,12-13H2,1-3H3