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

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]propanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-[2-[4-(2-pyridyl)piperazin-1-yl]sulfonylethyl]propanamide CAS Name: 2-[(4-chlorophenyl)thio]-N-[2-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]ethyl]propanamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]propanamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-[2-[4-(2-pyridyl)piperazino]sulfonylethyl]propionamide Formula: C20H25ClN4O3S2 MolecularWeight: 469.0205

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=N2)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)NCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=N2)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H25ClN4O3S2/c1-16(29-18-7-5-17(21)6-8-18)20(26)23-10-15-30(27,28)25-13-11-24(12-14-25)19-4-2-3-9-22-19/h2-9,16H,10-15H2,1H3,(H,23,26)