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acetamide, N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thien-2-yl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]-
SpectraBase Compound ID 6mfRJs9EToO
InChI InChI=1S/C23H22N6OS2/c1-2-11-29-17-9-5-3-8-15(17)20-21(29)26-23(28-27-20)31-13-19(30)25-22-16(12-24)14-7-4-6-10-18(14)32-22/h3,5,8-9H,2,4,6-7,10-11,13H2,1H3,(H,25,30)
InChIKey UMGATMNZAIAGTR-UHFFFAOYSA-N
Mol Weight 462.59 g/mol
Molecular Formula C23H22N6OS2
Exact Mass 462.129652 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 44e4aojK9Dh
Name acetamide, N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thien-2-yl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 462.129651699 u
Formula C23H22N6OS2
InChI InChI=1S/C23H22N6OS2/c1-2-11-29-17-9-5-3-8-15(17)20-21(29)26-23(28-27-20)31-13-19(30)25-22-16(12-24)14-7-4-6-10-18(14)32-22/h3,5,8-9H,2,4,6-7,10-11,13H2,1H3,(H,25,30)
InChIKey UMGATMNZAIAGTR-UHFFFAOYSA-N
Molecular Weight 462.590 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1219
Solvent DMSO-d6
Source Vendor ID: ZI/8158426; Lab Info: L-23,Kulikova; Lab Number: L-23/0006283