(2S)-2-(4-bromanyl-2-chloranyl-phenoxy)-1-[4-(phenylsulfonyl)piperazin-1-yl]propan-1-one

Systemtic Name: (2S)-2-(4-bromanyl-2-chloranyl-phenoxy)-1-[4-(phenylsulfonyl)piperazin-1-yl]propan-1-one Openeye Name: (2S)-1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(4-bromo-2-chloro-phenoxy)propan-1-one CAS Name: (2S)-1-[4-(benzenesulfonyl)-1-piperazinyl]-2-(4-bromo-2-chlorophenoxy)-1-propanone IUPAC Name: (2S)-1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(4-bromo-2-chlorophenoxy)propan-1-one Traditional Name: (2S)-1-(4-besylpiperazino)-2-(4-bromo-2-chloro-phenoxy)propan-1-one Formula: C19H20BrClN2O4S MolecularWeight: 487.7951

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrClN2O4S/c1-14(27-18-8-7-15(20)13-17(18)21)19(24)22-9-11-23(12-10-22)28(25,26)16-5-3-2-4-6-16/h2-8,13-14H,9-12H2,1H3/t14-/m0/s1