4-[(7-chloranyl-6-fluoranyl-2H-chromen-3-yl)sulfonyl]-1-[(1-ethanimidoyl-4-oxidanyl-piperidin-4-yl)methyl]piperazin-2-one

Systemtic Name: 4-[(7-chloranyl-6-fluoranyl-2H-chromen-3-yl)sulfonyl]-1-[(1-ethanimidoyl-4-oxidanyl-piperidin-4-yl)methyl]piperazin-2-one Openeye Name: 4-[(7-chloro-6-fluoro-2H-chromen-3-yl)sulfonyl]-1-[(1-ethanimidoyl-4-hydroxy-4-piperidyl)methyl]piperazin-2-one CAS Name: 4-[(7-chloro-6-fluoro-2H-1-benzopyran-3-yl)sulfonyl]-1-[[4-hydroxy-1-(1-iminoethyl)-4-piperidinyl]methyl]-2-piperazinone IUPAC Name: 4-[(7-chloro-6-fluoro-2H-chromen-3-yl)sulfonyl]-1-[(1-ethanimidoyl-4-hydroxypiperidin-4-yl)methyl]piperazin-2-one Traditional Name: 1-[(1-acetimidoyl-4-hydroxy-4-piperidyl)methyl]-4-[(7-chloro-6-fluoro-2H-chromen-3-yl)sulfonyl]piperazin-2-one Formula: C21H26ClFN4O5S MolecularWeight: 500.971343

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)(CN2CCN(CC2=O)S(=O)(=O)C3=CC4=CC(=C(C=C4OC3)Cl)F)O

Isomeric SMILES

CC(=N)N1CCC(CC1)(CN2CCN(CC2=O)S(=O)(=O)C3=CC4=CC(=C(C=C4OC3)Cl)F)O

InChI

InChI=1S/C21H26ClFN4O5S/c1-14(24)25-4-2-21(29,3-5-25)13-26-6-7-27(11-20(26)28)33(30,31)16-8-15-9-18(23)17(22)10-19(15)32-12-16/h8-10,24,29H,2-7,11-13H2,1H3