4-[4-(4-butoxy-3-fluoranyl-phenyl)piperazin-1-yl]sulfonyl-N-oxidanyl-1-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 4-[4-(4-butoxy-3-fluoranyl-phenyl)piperazin-1-yl]sulfonyl-N-oxidanyl-1-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 4-[4-(4-butoxy-3-fluoro-phenyl)piperazin-1-yl]sulfonyl-1-(3-pyridylmethyl)piperidine-4-carbohydroxamic acid CAS Name: 4-[[4-(4-butoxy-3-fluorophenyl)-1-piperazinyl]sulfonyl]-N-hydroxy-1-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 4-[4-(4-butoxy-3-fluorophenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 4-[4-(4-butoxy-3-fluoro-phenyl)piperazino]sulfonyl-1-(3-pyridylmethyl)piperidine-4-carbohydroxamic acid Formula: C26H36FN5O5S MolecularWeight: 549.657943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)N2CCN(CC2)S(=O)(=O)C3(CCN(CC3)CC4=CN=CC=C4)C(=O)NO)F

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)N2CCN(CC2)S(=O)(=O)C3(CCN(CC3)CC4=CN=CC=C4)C(=O)NO)F

InChI

InChI=1S/C26H36FN5O5S/c1-2-3-17-37-24-7-6-22(18-23(24)27)31-13-15-32(16-14-31)38(35,36)26(25(33)29-34)8-11-30(12-9-26)20-21-5-4-10-28-19-21/h4-7,10,18-19,34H,2-3,8-9,11-17,20H2,1H3,(H,29,33)