2-(3-chloranylphenoxy)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]propanamide

Systemtic Name: 2-(3-chloranylphenoxy)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]propanamide Openeye Name: 2-(3-chlorophenoxy)-N-[2-[4-(2-pyridyl)piperazin-1-yl]sulfonylethyl]propanamide CAS Name: 2-(3-chlorophenoxy)-N-[2-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]ethyl]propanamide IUPAC Name: 2-(3-chlorophenoxy)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]propanamide Traditional Name: 2-(3-chlorophenoxy)-N-[2-[4-(2-pyridyl)piperazino]sulfonylethyl]propionamide Formula: C20H25ClN4O4S MolecularWeight: 452.9549

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25ClN4O4S/c1-16(29-18-6-4-5-17(21)15-18)20(26)23-9-14-30(27,28)25-12-10-24(11-13-25)19-7-2-3-8-22-19/h2-8,15-16H,9-14H2,1H3,(H,23,26)