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2-Amino-4-butyl-6-[N-benzylindol-3'-yl]-1,3-pyrimidine

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2-Amino-4-butyl-6-[N-benzylindol-3'-yl]-1,3-pyrimidine
SpectraBase Compound ID PVYt1e7cRv
InChI InChI=1S/C23H24N4/c1-2-3-11-18-14-21(26-23(24)25-18)20-16-27(15-17-9-5-4-6-10-17)22-13-8-7-12-19(20)22/h4-10,12-14,16H,2-3,11,15H2,1H3,(H2,24,25,26)
InChIKey BGDCMOIZAXSMSG-UHFFFAOYSA-N
Mol Weight 356.47 g/mol
Molecular Formula C23H24N4
Exact Mass 356.200097 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 26uMvFnZE07
Name 2-Amino-4-butyl-6-[N-benzylindol-3'-yl]-1,3-pyrimidine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.200096789 u
Formula C23H24N4
InChI InChI=1S/C23H24N4/c1-2-3-11-18-14-21(26-23(24)25-18)20-16-27(15-17-9-5-4-6-10-17)22-13-8-7-12-19(20)22/h4-10,12-14,16H,2-3,11,15H2,1H3,(H2,24,25,26)
InChIKey BGDCMOIZAXSMSG-UHFFFAOYSA-N
Molecular Weight 356.473 g/mol
SMILES C1(=CN(CC2=CC=CC=C2)C=2C1=CC=CC2)C=1N=C(N)N=C(C1)CCCC