Compound ID | 250

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Benzothiazole Ethyl Urea Inhibitor Compound B

Class: Bacterial topoisomerase inhibitor

Spectrum of activity: Gram-negative
Details of activity: Staphylococcus aureus Streptococcus pneumoniae, enterococci and Clostridium difficile
Institute where first reported: Biota Europe Ltd., UK
Year first mentioned: 2013
Highest developmental phase: Preclinical
Development status: Active
Chemical structure(s):
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Molecular weight: 517.6
Iso. SMILES: OC(C1(C)CCN(C2=NC=C(C3=CC4=C(SC(NC(NCC)=O)=N4)C(C5=CC=CC=N5)=C3)C=N2)CC1)=O
InChI Key: VWGVZRSKDSKOCX-UHFFFAOYSA-N
Can. SMILES: CCNC(=O)NC1=NC2=C(C(=CC(=C2)C3=CN=C(N=C3)N4CCC(C)(CC4)C(=O)O)C5=NC=CC=C5)S1
InChI: InChI=1S/C26H27N7O3S/c1-3-27-24(36)32-25-31-20-13-16(12-18(21(20)37-25)19-6-4-5-9-28-19)17-14-29-23(30-15-17)33-10-7-26(2,8-11-33)22(34)35/h4-6,9,12-15H,3,7-8,10-11H2,1-2H3,(H,34,35)(H2,27,31,32,36)
External links:
Citations:
  • http://aac.asm.org/content/57/12/5977.full
  • https://journals.asm.org/doi/full/10.1128/aac.00719-13

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