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

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4-(2-Pyrrolyl)-2,6-dimethyl-3,5-bis-N-(2-methylphenyl)-carbamoyl-1,4-dihydro-pyridine
SpectraBase Compound ID 9XKOGvR0Fex
InChI InChI=1S/C27H28N4O2/c1-16-10-5-7-12-20(16)30-26(32)23-18(3)29-19(4)24(25(23)22-14-9-15-28-22)27(33)31-21-13-8-6-11-17(21)2/h5-15,25,28-29H,1-4H3,(H,30,32)(H,31,33)
InChIKey WONJYKMYZCAZBJ-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

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SpectraBase Spectrum ID 2Uze3cA6K0m
Name 4-(2-Pyrrolyl)-2,6-dimethyl-3,5-bis-N-(2-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/c1-16-10-5-7-12-20(16)30-26(32)23-18(3)29-19(4)24(25(23)22-14-9-15-28-22)27(33)31-21-13-8-6-11-17(21)2/h5-15,25,28-29H,1-4H3,(H,30,32)(H,31,33)
InChIKey WONJYKMYZCAZBJ-UHFFFAOYSA-N
Molecular Weight 440.547 g/mol
SMILES C=1(C(C(C(NC=2C(C)=CC=CC2)=O)=C(NC1C)C)C=1NC=CC1)C(NC=1C(C)=CC=CC1)=O