N-oxidanyl-7-[[2-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]sulfanyl]phenyl]amino]heptanamide

Systemtic Name: N-oxidanyl-7-[[2-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]sulfanyl]phenyl]amino]heptanamide Openeye Name: 7-[2-[[3-[(E)-2-(2-pyridyl)vinyl]-1H-indazol-6-yl]sulfanyl]anilino]heptanehydroxamic acid CAS Name: N-hydroxy-7-[2-[[3-[(E)-2-(2-pyridinyl)ethenyl]-1H-indazol-6-yl]thio]anilino]heptanamide IUPAC Name: N-hydroxy-7-[2-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]sulfanyl]anilino]heptanamide Traditional Name: 7-[2-[[3-[(E)-2-(2-pyridyl)vinyl]-1H-indazol-6-yl]thio]anilino]heptanehydroxamic acid Formula: C27H29N5O2S MolecularWeight: 487.61646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N5O2S/c33-27(32-34)12-3-1-2-7-18-29-24-10-4-5-11-26(24)35-21-14-15-22-23(30-31-25(22)19-21)16-13-20-9-6-8-17-28-20/h4-6,8-11,13-17,19,29,34H,1-3,7,12,18H2,(H,30,31)(H,32,33)/b16-13+