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Methyl 4-{[2-(Dimethylamino)ethyl]amino}-8-isopropyl-2-phenyl-5,8,9,10-tetrahydropyrimido[4,5-d]-azocine-6-carboxylate
SpectraBase Compound ID AtcMRwfcgaj
InChI InChI=1S/C24H33N5O2/c1-17(2)29-13-11-21-20(15-19(16-29)24(30)31-5)23(25-12-14-28(3)4)27-22(26-21)18-9-7-6-8-10-18/h6-10,16-17H,11-15H2,1-5H3,(H,25,26,27)/b19-16+
InChIKey JJJDBAUUPLMJIP-KNTRCKAVSA-N
Mol Weight 423.6 g/mol
Molecular Formula C24H33N5O2
Exact Mass 423.263425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3YLo3wKK3GA
Name Methyl 4-{[2-(Dimethylamino)ethyl]amino}-8-isopropyl-2-phenyl-5,8,9,10-tetrahydropyrimido[4,5-d]-azocine-6-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H33N5O2
InChI InChI=1S/C24H33N5O2/c1-17(2)29-13-11-21-20(15-19(16-29)24(30)31-5)23(25-12-14-28(3)4)27-22(26-21)18-9-7-6-8-10-18/h6-10,16-17H,11-15H2,1-5H3,(H,25,26,27)/b19-16+
InChIKey JJJDBAUUPLMJIP-KNTRCKAVSA-N
Molecular Weight 423.561 g/mol
SMILES N(c1nc(nc2c1C\C(=C/N(CC2)C(C)C)C(=O)OC)-c1ccccc1)CCN(C)C
SPLASH splash10-0zgi-2019000000-25a9f816ea5d8bafde23
Source of Spectrum HC-49-1186-17
Synonyms (E)-methyl 4-((2-(dimethylamino)ethyl)amino)-8-isopropyl-2-phenyl-5,8,9,10-tetrahydropyrimido[4,5-d]azocine-6-carboxylate
Wiley ID 1742447