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

Systemtic Name: 2-[4-[2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanylethanoyl]piperazin-1-yl]-N-(2-ethylphenyl)ethanamide Openeye Name: 2-[4-[2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]acetyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide CAS Name: 2-[4-[2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-1-oxoethyl]-1-piperazinyl]-N-(2-ethylphenyl)acetamide IUPAC Name: 2-[4-[2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanylacetyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide Traditional Name: 2-[4-[2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]acetyl]piperazino]-N-(2-ethylphenyl)acetamide Formula: C25H29N5O3S MolecularWeight: 479.59446

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN2CCN(CC2)C(=O)CSC3=NC(=C(C=C3C#N)C(=O)C)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN2CCN(CC2)C(=O)CSC3=NC(=C(C=C3C#N)C(=O)C)C

InChI

InChI=1S/C25H29N5O3S/c1-4-19-7-5-6-8-22(19)28-23(32)15-29-9-11-30(12-10-29)24(33)16-34-25-20(14-26)13-21(18(3)31)17(2)27-25/h5-8,13H,4,9-12,15-16H2,1-3H3,(H,28,32)