2-(4-cyanophenoxy)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]propanamide

Systemtic Name: 2-(4-cyanophenoxy)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]propanamide Openeye Name: 2-(4-cyanophenoxy)-N-[2-[4-(2-pyridyl)piperazin-1-yl]sulfonylethyl]propanamide CAS Name: 2-(4-cyanophenoxy)-N-[2-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]ethyl]propanamide IUPAC Name: 2-(4-cyanophenoxy)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]propanamide Traditional Name: 2-(4-cyanophenoxy)-N-[2-[4-(2-pyridyl)piperazino]sulfonylethyl]propionamide Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=N2)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C(=O)NCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=N2)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H25N5O4S/c1-17(30-19-7-5-18(16-22)6-8-19)21(27)24-10-15-31(28,29)26-13-11-25(12-14-26)20-4-2-3-9-23-20/h2-9,17H,10-15H2,1H3,(H,24,27)