2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-[3-cyano-1-(4-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]ethanamide

Systemtic Name: 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-[3-cyano-1-(4-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]ethanamide Openeye Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-[3-cyano-1-(4-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]acetamide CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-N-[3-cyano-1-(4-fluorophenyl)-4,5-dimethyl-2-pyrrolyl]acetamide IUPAC Name: 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-N-[3-cyano-1-(4-fluorophenyl)-4,5-dimethylpyrrol-2-yl]acetamide Traditional Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]-N-[3-cyano-1-(4-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]acetamide Formula: C23H20FN5OS MolecularWeight: 433.501203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)NC2=C(C(=C(N2C3=CC=C(C=C3)F)C)C)C#N)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)NC2=C(C(=C(N2C3=CC=C(C=C3)F)C)C)C#N)C

InChI

InChI=1S/C23H20FN5OS/c1-13-9-14(2)27-23(19(13)10-25)31-12-21(30)28-22-20(11-26)15(3)16(4)29(22)18-7-5-17(24)6-8-18/h5-9H,12H2,1-4H3,(H,28,30)