2-[4-[2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanylethanoyl]piperazin-1-yl]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[4-[2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanylethanoyl]piperazin-1-yl]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[4-[2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]acetyl]piperazin-1-yl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[4-[2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-1-oxoethyl]-1-piperazinyl]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[4-[2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanylacetyl]piperazin-1-yl]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[4-[2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]acetyl]piperazino]-N-(4-fluorophenyl)acetamide Formula: C23H24FN5O3S MolecularWeight: 469.531763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC(=O)N2CCN(CC2)CC(=O)NC3=CC=C(C=C3)F)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC(=O)N2CCN(CC2)CC(=O)NC3=CC=C(C=C3)F)C#N)C(=O)C

InChI

InChI=1S/C23H24FN5O3S/c1-15-20(16(2)30)11-17(12-25)23(26-15)33-14-22(32)29-9-7-28(8-10-29)13-21(31)27-19-5-3-18(24)4-6-19/h3-6,11H,7-10,13-14H2,1-2H3,(H,27,31)