(2S)-N-[2-[4-(3-chlorophenyl)piperazin-1-yl]sulfonylethyl]-2-phenoxy-propanamide

Systemtic Name: (2S)-N-[2-[4-(3-chlorophenyl)piperazin-1-yl]sulfonylethyl]-2-phenoxy-propanamide Openeye Name: (2S)-N-[2-[4-(3-chlorophenyl)piperazin-1-yl]sulfonylethyl]-2-phenoxy-propanamide CAS Name: (2S)-N-[2-[[4-(3-chlorophenyl)-1-piperazinyl]sulfonyl]ethyl]-2-phenoxypropanamide IUPAC Name: (2S)-N-[2-[4-(3-chlorophenyl)piperazin-1-yl]sulfonylethyl]-2-phenoxypropanamide Traditional Name: (2S)-N-[2-[4-(3-chlorophenyl)piperazino]sulfonylethyl]-2-phenoxy-propionamide Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)NCCS(=O)(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)OC3=CC=CC=C3

InChI

InChI=1S/C21H26ClN3O4S/c1-17(29-20-8-3-2-4-9-20)21(26)23-10-15-30(27,28)25-13-11-24(12-14-25)19-7-5-6-18(22)16-19/h2-9,16-17H,10-15H2,1H3,(H,23,26)/t17-/m0/s1