CID 214460

Brn 0964055

Structural Information

Molecular Formula
C17H17N3O3S
SMILES
CN(C)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)CN=C2C3=CC=CC=C3
InChI
InChI=1S/C17H17N3O3S/c1-20(2)24(22,23)13-8-9-15-14(10-13)17(18-11-16(21)19-15)12-6-4-3-5-7-12/h3-10H,11H2,1-2H3,(H,19,21)
InChIKey
QOILOOGANXGBOY-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepine-7-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

343.09906 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.10634 179.6
[M+Na]+ 366.08828 190.4
[M+NH4]+ 361.13288 185.3
[M+K]+ 382.06222 184.2
[M-H]- 342.09178 181.9
[M+Na-2H]- 364.07373 185.9
[M]+ 343.09851 182.2
[M]- 343.09961 182.2
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.