3-(4-aminophenyl)-1-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]propan-1-one

Systemtic Name: 3-(4-aminophenyl)-1-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]propan-1-one Openeye Name: 3-(4-aminophenyl)-1-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]propan-1-one CAS Name: 3-(4-aminophenyl)-1-[4-(4-methylsulfonyl-1-piperazinyl)phenyl]-1-propanone IUPAC Name: 3-(4-aminophenyl)-1-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]propan-1-one Traditional Name: 3-(4-aminophenyl)-1-[4-(4-mesylpiperazino)phenyl]propan-1-one Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)C(=O)CCC3=CC=C(C=C3)N

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)C(=O)CCC3=CC=C(C=C3)N

InChI

InChI=1S/C20H25N3O3S/c1-27(25,26)23-14-12-22(13-15-23)19-9-5-17(6-10-19)20(24)11-4-16-2-7-18(21)8-3-16/h2-3,5-10H,4,11-15,21H2,1H3