N-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethanamide

Systemtic Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethanamide Openeye Name: 2-(4-acetylpiperazin-1-yl)-N-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]-2-oxo-acetamide CAS Name: 2-(4-acetyl-1-piperazinyl)-N-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-2-oxoacetamide IUPAC Name: 2-(4-acetylpiperazin-1-yl)-N-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-ylethyl]-2-oxoacetamide Traditional Name: 2-(4-acetylpiperazino)-N-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]-2-keto-acetamide Formula: C23H28N4O5S MolecularWeight: 472.55722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)N2CCN(CC2)C(=O)C)C3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)N2CCN(CC2)C(=O)C)C3=CN=CC=C3)C

InChI

InChI=1S/C23H28N4O5S/c1-16-6-7-20(13-17(16)2)33(31,32)21(19-5-4-8-24-14-19)15-25-22(29)23(30)27-11-9-26(10-12-27)18(3)28/h4-8,13-14,21H,9-12,15H2,1-3H3,(H,25,29)