[4-(3-bromophenyl)piperazin-1-yl]-(5-methylsulfonyl-2-morpholin-4-yl-phenyl)methanone

Systemtic Name: [4-(3-bromophenyl)piperazin-1-yl]-(5-methylsulfonyl-2-morpholin-4-yl-phenyl)methanone Openeye Name: [4-(3-bromophenyl)piperazin-1-yl]-(5-methylsulfonyl-2-morpholino-phenyl)methanone CAS Name: [4-(3-bromophenyl)-1-piperazinyl]-[5-methylsulfonyl-2-(4-morpholinyl)phenyl]methanone IUPAC Name: [4-(3-bromophenyl)piperazin-1-yl]-(5-methylsulfonyl-2-morpholin-4-ylphenyl)methanone Traditional Name: [4-(3-bromophenyl)piperazino]-(5-mesyl-2-morpholino-phenyl)methanone Formula: C22H26BrN3O4S MolecularWeight: 508.42854

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Br

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C22H26BrN3O4S/c1-31(28,29)19-5-6-21(25-11-13-30-14-12-25)20(16-19)22(27)26-9-7-24(8-10-26)18-4-2-3-17(23)15-18/h2-6,15-16H,7-14H2,1H3