SpectraBase Spectrum ID |
CDAc2FapVKX |
Name |
2-{[2-(2-ethyl-1-piperidinyl)-2-oxoethyl]sulfanyl}-3-(4-methylphenyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
460.193297330 u |
Formula |
C26H28N4O2S |
InChI |
InChI=1S/C26H28N4O2S/c1-3-18-8-6-7-15-29(18)22(31)16-33-26-28-23-20-9-4-5-10-21(20)27-24(23)25(32)30(26)19-13-11-17(2)12-14-19/h4-5,9-14,18,27H,3,6-8,15-16H2,1-2H3 |
InChIKey |
BVTDLEQYCFOGGE-UHFFFAOYSA-N |
Molecular Weight |
460.596 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_8643 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13219934 |