N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]-2-(2,4,6-trimethylphenoxy)ethanamide

Systemtic Name: N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]-2-(2,4,6-trimethylphenoxy)ethanamide Openeye Name: N-[2-[4-(2-pyridyl)piperazin-1-yl]sulfonylethyl]-2-(2,4,6-trimethylphenoxy)acetamide CAS Name: N-[2-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]ethyl]-2-(2,4,6-trimethylphenoxy)acetamide IUPAC Name: N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]-2-(2,4,6-trimethylphenoxy)acetamide Traditional Name: N-[2-[4-(2-pyridyl)piperazino]sulfonylethyl]-2-(2,4,6-trimethylphenoxy)acetamide Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCC(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=N3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCC(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=N3)C

InChI

InChI=1S/C22H30N4O4S/c1-17-14-18(2)22(19(3)15-17)30-16-21(27)24-8-13-31(28,29)26-11-9-25(10-12-26)20-6-4-5-7-23-20/h4-7,14-15H,8-13,16H2,1-3H3,(H,24,27)