N'-oxidanyl-N-[2-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]sulfanyl]phenyl]octanediamide

Systemtic Name: N'-oxidanyl-N-[2-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]sulfanyl]phenyl]octanediamide Openeye Name: 8-(hydroxyamino)-8-oxo-N-[2-[[3-[(E)-2-(2-pyridyl)vinyl]-1H-indazol-6-yl]sulfanyl]phenyl]octanamide CAS Name: N'-hydroxy-N-[2-[[3-[(E)-2-(2-pyridinyl)ethenyl]-1H-indazol-6-yl]thio]phenyl]octanediamide IUPAC Name: N'-hydroxy-N-[2-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]sulfanyl]phenyl]octanediamide Traditional Name: 8-(hydroxyamino)-8-keto-N-[2-[[3-[(E)-2-(2-pyridyl)vinyl]-1H-indazol-6-yl]thio]phenyl]caprylamide Formula: C28H29N5O3S MolecularWeight: 515.62656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CCCCCCC(=O)NO)SC2=CC3=C(C=C2)C(=NN3)C=CC4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CCCCCCC(=O)NO)SC2=CC3=C(C=C2)C(=NN3)/C=C/C4=CC=CC=N4

InChI

InChI=1S/C28H29N5O3S/c34-27(12-3-1-2-4-13-28(35)33-36)30-24-10-5-6-11-26(24)37-21-15-16-22-23(31-32-25(22)19-21)17-14-20-9-7-8-18-29-20/h5-11,14-19,36H,1-4,12-13H2,(H,30,34)(H,31,32)(H,33,35)/b17-14+