CID 376657

Nsc657703

Structural Information

Molecular Formula
C19H15N5O2S
SMILES
C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)N=NC3=C(NC4=CC=CC=C43)O
InChI
InChI=1S/C19H15N5O2S/c25-16(20-12-6-2-1-3-7-12)10-13-11-27-19(21-13)24-23-17-14-8-4-5-9-15(14)22-18(17)26/h1-9,11,22,26H,10H2,(H,20,25)
InChIKey
XEYRUBDXGZQFDO-UHFFFAOYSA-N
Compound name
2-[2-[(2-hydroxy-1H-indol-3-yl)diazenyl]-1,3-thiazol-4-yl]-N-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

377.09464 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.10192 182.6
[M+Na]+ 400.08386 191.3
[M-H]- 376.08736 192.5
[M+NH4]+ 395.12846 196.1
[M+K]+ 416.05780 185.3
[M+H-H2O]+ 360.09190 174.0
[M+HCOO]- 422.09284 205.0
[M+CH3COO]- 436.10849 193.6
[M+Na-2H]- 398.06931 186.3
[M]+ 377.09409 186.5
[M]- 377.09519 186.5
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.