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2-({2-[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-2-oxoethyl}sulfanyl)-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-({2-[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-2-oxoethyl}sulfanyl)-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID 7StSyQ0UVab
InChI InChI=1S/C29H27N5O2S3/c35-24(32-14-16-33(17-15-32)28-30-21-11-5-7-13-23(21)39-28)18-37-29-31-26-25(20-10-4-6-12-22(20)38-26)27(36)34(29)19-8-2-1-3-9-19/h1-3,5,7-9,11,13H,4,6,10,12,14-18H2
InChIKey DWIRPHGVDWUMSC-UHFFFAOYSA-N
Mol Weight 573.75 g/mol
Molecular Formula C29H27N5O2S3
Exact Mass 573.132689 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LXj0m3SUacu
Name benzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 2-[[2-[4-(2-benzothiazolyl)-1-piperazinyl]-2-oxoethyl]thio]-5,6,7,8-tetrahydro-3-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 573.132688649 u
Formula C29H27N5O2S3
InChI InChI=1S/C29H27N5O2S3/c35-24(32-14-16-33(17-15-32)28-30-21-11-5-7-13-23(21)39-28)18-37-29-31-26-25(20-10-4-6-12-22(20)38-26)27(36)34(29)19-8-2-1-3-9-19/h1-3,5,7-9,11,13H,4,6,10,12,14-18H2
InChIKey DWIRPHGVDWUMSC-UHFFFAOYSA-N
Molecular Weight 573.748 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8318
Solvent DMSO-d6
Source Vendor ID: NMR/9321715; Lab Info: LP; Lab Number: LP-0699111