PB49673382 - Small Molecule (ID:11953-101)

HMS LINCS ID: 11953-101
Name: PB49673382
Alternative Names:
LINCS ID:
PubChem CID:
ChEBI ID:
ChEMBL ID:
Molecular Mass: 598.09
InChi: InChI=1S/C26H23ClN6O5S2/c27-20-8-4-5-9-21(20)31-40(36,37)24-16-19(33(34)35)10-11-22(24)30-28-17-23-25(18-6-2-1-3-7-18)29-26(39-23)32-12-14-38-15-13-32/h1-11,16-17,30-31H,12-15H2/b28-17+
InChi Key: WKQHWXDENFKTTR-OGLMXYFKSA-N
SMILES: O=S(C(C=C([N+]([O-])=O)C=C1)=C1N/N=C/C2=C(C3=CC=CC=C3)N=C(S2)N4CCOCC4)(NC5=C(Cl)C=CC=C5)=O
Relevant Citations:
Comments:
Date Publicly Available:
Most Recent Update: 2018-08-09

Batch Information for HMSL11953-101-1:

HMS LINCS Batch ID: 11953-101-1
Provider: UkrOrgSyntez
Provider Batch ID:
Salt: 101
Molecular Formula:
Molecular Weight: 599.08
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2018-08-09
Most Recent Update: 2018-08-09

HMS QC Testing Events for HMSL11953-101-1:

Date HMS QC Outcome Comment Files
06/03/2016 PASS HMSL11953-101-1-MS.pdf,
HMSL11953-101-1-LC.pdf