N-[2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylphenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylphenyl]-4-fluoranyl-benzamide Openeye Name: N-[2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]phenyl]-4-fluoro-benzamide CAS Name: N-[2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]phenyl]-4-fluorobenzamide IUPAC Name: N-[2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylphenyl]-4-fluorobenzamide Traditional Name: N-[2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]phenyl]-4-fluoro-benzamide Formula: C21H16FN3OS MolecularWeight: 377.434643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SC2=CC=CC=C2NC(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC2=CC=CC=C2NC(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H16FN3OS/c1-13-11-14(2)24-21(17(13)12-23)27-19-6-4-3-5-18(19)25-20(26)15-7-9-16(22)10-8-15/h3-11H,1-2H3,(H,25,26)