Details of the Drug

General Information of Drug (ID: DM8OWRP)

Drug Name

CRS-3123

Synonyms

REP-3123; MetRS inhibitor (antibiotic, Clostridium difficile infection), Crestone; Methionyl tRNA synthetaseinhibitor (antibiotic, Clostridium difficile infection), Crestone

Indication

Disease Entry	ICD 11	Status	REF
Clostridium infection	1A04	Phase 1	[1]
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Structure

3D MOL

2D MOL

Chemical Identifiers

Formula: C19H19Br2N3O2S
Canonical SMILES: C1COC2=C(C1NCCCNC3=CC(=O)C4=C(N3)C=CS4)C=C(C=C2Br)Br
InChI: 1S/C19H19Br2N3O2S/c20-11-8-12-14(2-6-26-18(12)13(21)9-11)22-4-1-5-23-17-10-16(25)19-15(24-17)3-7-27-19/h3,7-10,14,22H,1-2,4-6H2,(H2,23,24,25)/t14-/m1/s1
InChIKey: NNTYBKTXMKBRFA-CQSZACIVSA-N

Cross-matching ID

PubChem CID: 16744283
CAS Number: 1013915-71-3
UNII: 2P987FW4E8
DrugBank ID: DB12262
TTD ID: D05QHU

References

1	ClinicalTrials.gov (NCT01551004) Phase I Trial of a Single Dose of CRS3123. U.S. National Institutes of Health.