CID 3000590

2-(2-hydroxyanilino)-n-(1-naphthyl)-2-thioxo-acetamide

Structural Information

Molecular Formula
C18H14N2O2S
SMILES
C1=CC=C2C(=C1)C=CC=C2NC(=O)C(=S)NC3=CC=CC=C3O
InChI
InChI=1S/C18H14N2O2S/c21-16-11-4-3-9-15(16)20-18(23)17(22)19-14-10-5-7-12-6-1-2-8-13(12)14/h1-11,21H,(H,19,22)(H,20,23)
InChIKey
VTTASKMNNUGASL-UHFFFAOYSA-N
Compound name
2-(2-hydroxyanilino)-N-naphthalen-1-yl-2-sulfanylideneacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.0776 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.084876 171.1
[M+Na]+ 345.066818 177.2
[M-H]- 321.070324 177.1
[M+NH4]+ 340.111423 185.2
[M+K]+ 361.040758 171.0
[M+H-H2O]+ 305.074860 163.4
[M+HCOO]- 367.075801 188.1
[M+CH3COO]- 381.091451 181.2
[M+Na-2H]- 343.052266 175.3
[M]+ 322.07705142 170.3
[M]- 322.07814858 170.3
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.