CID 5911958
2-[(3z)-3-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-2-oxo-2,3-dihydro-1h-indol-1-yl]-n-(2-methylphenyl)acetamide
Structural Information
- Molecular Formula
- C26H27N3O3S2
- SMILES
- CCCCCCN1C(=O)/C(=C/2\C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC=CC=C4C)/SC1=S
- InChI
- InChI=1S/C26H27N3O3S2/c1-3-4-5-10-15-28-25(32)23(34-26(28)33)22-18-12-7-9-14-20(18)29(24(22)31)16-21(30)27-19-13-8-6-11-17(19)2/h6-9,11-14H,3-5,10,15-16H2,1-2H3,(H,27,30)/b23-22-
- InChIKey
- CKBRVIZPLUXYQQ-FCQUAONHSA-N
- Compound name
- 2-[(3Z)-3-(3-hexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-oxoindol-1-yl]-N-(2-methylphenyl)acetamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 494.15666 | 220.3 |
[M+Na]+ | 516.13860 | 227.7 |
[M-H]- | 492.14210 | 228.1 |
[M+NH4]+ | 511.18320 | 230.6 |
[M+K]+ | 532.11254 | 219.1 |
[M+H-H2O]+ | 476.14664 | 213.7 |
[M+HCOO]- | 538.14758 | 228.1 |
[M+CH3COO]- | 552.16323 | 239.9 |
[M+Na-2H]- | 514.12405 | 212.0 |
[M]+ | 493.14883 | 224.4 |
[M]- | 493.14993 | 224.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.