CID 3042282

Benzeneacetamide, n-(((2-(1h-benzimidazol-1-yl)ethyl)amino)carbonyl)-

Structural Information

Molecular Formula
C18H18N4O2
SMILES
C1=CC=C(C=C1)CC(=O)NC(=O)NCCN2C=NC3=CC=CC=C32
InChI
InChI=1S/C18H18N4O2/c23-17(12-14-6-2-1-3-7-14)21-18(24)19-10-11-22-13-20-15-8-4-5-9-16(15)22/h1-9,13H,10-12H2,(H2,19,21,23,24)
InChIKey
VZGGGQQGDGPLEQ-UHFFFAOYSA-N
Compound name
N-[2-(benzimidazol-1-yl)ethylcarbamoyl]-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.14297 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.150246 174.0
[M+Na]+ 345.132188 180.1
[M-H]- 321.135694 179.1
[M+NH4]+ 340.176793 187.2
[M+K]+ 361.106128 175.3
[M+H-H2O]+ 305.140230 164.1
[M+HCOO]- 367.141171 197.3
[M+CH3COO]- 381.156821 209.9
[M+Na-2H]- 343.117636 179.7
[M]+ 322.14242142 175.4
[M]- 322.14351858 175.4
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.