2-[4-[(4-chloranyl-2-methylsulfonyl-phenyl)methyl]piperazin-1-yl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[4-[(4-chloranyl-2-methylsulfonyl-phenyl)methyl]piperazin-1-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[4-[(4-chloro-2-methylsulfonyl-phenyl)methyl]piperazin-1-yl]-1-morpholino-ethanone CAS Name: 2-[4-[(4-chloro-2-methylsulfonylphenyl)methyl]-1-piperazinyl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[4-[(4-chloro-2-methylsulfonylphenyl)methyl]piperazin-1-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[4-(4-chloro-2-mesyl-benzyl)piperazino]-1-morpholino-ethanone Formula: C18H26ClN3O4S MolecularWeight: 415.93474

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)Cl)CN2CCN(CC2)CC(=O)N3CCOCC3

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)Cl)CN2CCN(CC2)CC(=O)N3CCOCC3

InChI

InChI=1S/C18H26ClN3O4S/c1-27(24,25)17-12-16(19)3-2-15(17)13-20-4-6-21(7-5-20)14-18(23)22-8-10-26-11-9-22/h2-3,12H,4-11,13-14H2,1H3