CID 1571667

2-{[(2-chlorophenoxy)acetyl]amino}-5,6-dihydro-4h-cyclopenta[b]thiophene-3-carboxamide

Structural Information

Molecular Formula
C16H15ClN2O3S
SMILES
C1CC2=C(C1)SC(=C2C(=O)N)NC(=O)COC3=CC=CC=C3Cl
InChI
InChI=1S/C16H15ClN2O3S/c17-10-5-1-2-6-11(10)22-8-13(20)19-16-14(15(18)21)9-4-3-7-12(9)23-16/h1-2,5-6H,3-4,7-8H2,(H2,18,21)(H,19,20)
InChIKey
LMHPVMKQEAONLK-UHFFFAOYSA-N
Compound name
2-[[2-(2-chlorophenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.0492 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.05648 178.0
[M+Na]+ 373.03842 186.8
[M+NH4]+ 368.08302 185.7
[M+K]+ 389.01236 182.7
[M-H]- 349.04192 181.3
[M+Na-2H]- 371.02387 181.7
[M]+ 350.04865 180.6
[M]- 350.04975 180.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.