[1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]piperidin-4-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]piperidin-4-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [1-[(2-chloro-6-fluoro-phenyl)methylsulfonyl]-4-piperidyl]-(4-methylpiperazin-1-yl)methanone CAS Name: [1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-4-piperidinyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [1-[(2-chloro-6-fluorophenyl)methylsulfonyl]piperidin-4-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [1-(2-chloro-6-fluoro-benzyl)sulfonyl-4-piperidyl]-(4-methylpiperazino)methanone Formula: C18H25ClFN3O3S MolecularWeight: 417.925803

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CN1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H25ClFN3O3S/c1-21-9-11-22(12-10-21)18(24)14-5-7-23(8-6-14)27(25,26)13-15-16(19)3-2-4-17(15)20/h2-4,14H,5-13H2,1H3