2-(4-bromanylphenoxy)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-(4-bromanylphenoxy)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 2-(4-bromophenoxy)-1-[4-(p-tolylsulfonyl)piperazin-1-yl]propan-1-one CAS Name: 2-(4-bromophenoxy)-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-bromophenoxy)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 2-(4-bromophenoxy)-1-(4-tosylpiperazino)propan-1-one Formula: C20H23BrN2O4S MolecularWeight: 467.37662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C)OC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H23BrN2O4S/c1-15-3-9-19(10-4-15)28(25,26)23-13-11-22(12-14-23)20(24)16(2)27-18-7-5-17(21)6-8-18/h3-10,16H,11-14H2,1-2H3