For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-(2-Pyrrolyl)-2,6-dimethyl-3,5-bis-N-(4-methylphenyl)-carbamoyl-1,4-dihydro-pyridine

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

4-(2-Pyrrolyl)-2,6-dimethyl-3,5-bis-N-(4-methylphenyl)-carbamoyl-1,4-dihydro-pyridine
SpectraBase Compound ID InqhCKrlKdQ
InChI InChI=1S/C27H28N4O2/c1-16-7-11-20(12-8-16)30-26(32)23-18(3)29-19(4)24(25(23)22-6-5-15-28-22)27(33)31-21-13-9-17(2)10-14-21/h5-15,25,28-29H,1-4H3,(H,30,32)(H,31,33)
InChIKey BGZAIIBIPRCFOS-UHFFFAOYSA-N
Mol Weight 440.55 g/mol
Molecular Formula C27H28N4O2
Exact Mass 440.221226 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4M17hWKdJp6
Name 4-(2-Pyrrolyl)-2,6-dimethyl-3,5-bis-N-(4-methylphenyl)-carbamoyl-1,4-dihydro-pyridine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 440.221226156 u
Formula C27H28N4O2
InChI InChI=1S/C27H28N4O2/c1-16-7-11-20(12-8-16)30-26(32)23-18(3)29-19(4)24(25(23)22-6-5-15-28-22)27(33)31-21-13-9-17(2)10-14-21/h5-15,25,28-29H,1-4H3,(H,30,32)(H,31,33)
InChIKey BGZAIIBIPRCFOS-UHFFFAOYSA-N
Molecular Weight 440.547 g/mol
SMILES C=1(C(C(C(NC2=CC=C(C=C2)C)=O)=C(NC1C)C)C=1NC=CC1)C(NC1=CC=C(C=C1)C)=O