(E)-6-[1-[(E)-5-(5-bromanylthiophen-2-yl)-3-oxidanyl-pent-1-enyl]-2,4-bis(oxidanyl)cyclopentyl]-7-oxidanylidene-hept-2-enamide

Systemtic Name: (E)-6-[1-[(E)-5-(5-bromanylthiophen-2-yl)-3-oxidanyl-pent-1-enyl]-2,4-bis(oxidanyl)cyclopentyl]-7-oxidanylidene-hept-2-enamide Openeye Name: (E)-6-[1-[(E)-5-(5-bromo-2-thienyl)-3-hydroxy-pent-1-enyl]-2,4-dihydroxy-cyclopentyl]-7-oxo-hept-2-enamide CAS Name: (E)-6-[1-[(E)-5-(5-bromo-2-thiophenyl)-3-hydroxypent-1-enyl]-2,4-dihydroxycyclopentyl]-7-oxo-2-heptenamide IUPAC Name: (E)-6-[1-[(E)-5-(5-bromothiophen-2-yl)-3-hydroxypent-1-enyl]-2,4-dihydroxycyclopentyl]-7-oxohept-2-enamide Traditional Name: (E)-6-[1-[(E)-5-(5-bromo-2-thienyl)-3-hydroxy-pent-1-enyl]-2,4-dihydroxy-cyclopentyl]-7-keto-hept-2-enamide Formula: C21H28BrNO5S MolecularWeight: 486.41972

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(C1O)(C=CC(CCC2=CC=C(S2)Br)O)C(CCC=CC(=O)N)C=O)O

Isomeric SMILES

C1C(CC(C1O)(/C=C/C(CCC2=CC=C(S2)Br)O)C(CC/C=C/C(=O)N)C=O)O

InChI

InChI=1S/C21H28BrNO5S/c22-19-8-7-17(29-19)6-5-15(25)9-10-21(12-16(26)11-18(21)27)14(13-24)3-1-2-4-20(23)28/h2,4,7-10,13-16,18,25-27H,1,3,5-6,11-12H2,(H2,23,28)/b4-2+,10-9+