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ethyl 6-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-4-(2-chlorophenyl)-5-cyano-2-phenyl-1,4-dihydro-3-pyridinecarboxylate

View entire compound with spectra: 1 NMR

ethyl 6-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-4-(2-chlorophenyl)-5-cyano-2-phenyl-1,4-dihydro-3-pyridinecarboxylate
SpectraBase Compound ID AJo6STwihHL
InChI InChI=1S/C30H25Cl2N3O3S/c1-3-38-30(37)27-26(21-11-7-8-12-23(21)31)22(16-33)29(35-28(27)19-9-5-4-6-10-19)39-17-25(36)34-20-14-13-18(2)24(32)15-20/h4-15,26,35H,3,17H2,1-2H3,(H,34,36)
InChIKey XBDLPMNYOQGMSV-UHFFFAOYSA-N
Mol Weight 578.51 g/mol
Molecular Formula C30H25Cl2N3O3S
Exact Mass 577.099368 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8rlQ4WkVHFv
Name ethyl 6-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-4-(2-chlorophenyl)-5-cyano-2-phenyl-1,4-dihydro-3-pyridinecarboxylate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 577.099368248 u
Formula C30H25Cl2N3O3S
InChI InChI=1S/C30H25Cl2N3O3S/c1-3-38-30(37)27-26(21-11-7-8-12-23(21)31)22(16-33)29(35-28(27)19-9-5-4-6-10-19)39-17-25(36)34-20-14-13-18(2)24(32)15-20/h4-15,26,35H,3,17H2,1-2H3,(H,34,36)
InChIKey XBDLPMNYOQGMSV-UHFFFAOYSA-N
Molecular Weight 578.514 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1720
Solvent DMSO-d6
Source Vendor ID: NMR/12278301