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2-amino-4-(5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
SpectraBase Compound ID F9WL25R3j7P
InChI InChI=1S/C25H24ClN3S/c1-15-11-16(2)21(12-17(15)14-30-19-9-7-18(26)8-10-19)24-20-5-3-4-6-23(20)29-25(28)22(24)13-27/h7-12H,3-6,14H2,1-2H3,(H2,28,29)
InChIKey LUHCUJWPNKMMMO-UHFFFAOYSA-N
Mol Weight 434.0 g/mol
Molecular Formula C25H24ClN3S
Exact Mass 433.137947 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GJfqJugxplj
Name 2-amino-4-(5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H24ClN3S/c1-15-11-16(2)21(12-17(15)14-30-19-9-7-18(26)8-10-19)24-20-5-3-4-6-23(20)29-25(28)22(24)13-27/h7-12H,3-6,14H2,1-2H3,(H2,28,29)
InChIKey LUHCUJWPNKMMMO-UHFFFAOYSA-N
NMR Offset 17.5285
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14703
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/1020007; UBI_ID: UBI-014706
Temperature 300 °C