4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-N-oxidanyl-1-(pyridin-4-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-N-oxidanyl-1-(pyridin-4-ylmethyl)piperidine-4-carboxamide Openeye Name: 4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-1-(4-pyridylmethyl)piperidine-4-carbohydroxamic acid CAS Name: 4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-N-hydroxy-1-(pyridin-4-ylmethyl)-4-piperidinecarboxamide IUPAC Name: 4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-N-hydroxy-1-(pyridin-4-ylmethyl)piperidine-4-carboxamide Traditional Name: 4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-1-(4-pyridylmethyl)piperidine-4-carbohydroxamic acid Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCNC1=CC=C(C=C1)S(=O)(=O)CC2(CCN(CC2)CC3=CC=NC=C3)C(=O)NO

Isomeric SMILES

CC#CCNC1=CC=C(C=C1)S(=O)(=O)CC2(CCN(CC2)CC3=CC=NC=C3)C(=O)NO

InChI

InChI=1S/C23H28N4O4S/c1-2-3-12-25-20-4-6-21(7-5-20)32(30,31)18-23(22(28)26-29)10-15-27(16-11-23)17-19-8-13-24-14-9-19/h4-9,13-14,25,29H,10-12,15-18H2,1H3,(H,26,28)