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6-(2-Carbethoxymethyl-imidazo[1,2-a]pyrimidin-7-yl)-5-(1-pyrrolyl)-4-methyl-2-phenylthieno[2,3-d]pyrimidine
SpectraBase Compound ID CCvnfL9bszb
InChI InChI=1S/C27H22N6O2S/c1-3-35-21(34)15-19-16-33-14-11-20(30-27(33)29-19)24-23(32-12-7-8-13-32)22-17(2)28-25(31-26(22)36-24)18-9-5-4-6-10-18/h4-14,16H,3,15H2,1-2H3
InChIKey UMFQFJCVNUOVLE-UHFFFAOYSA-N
Mol Weight 494.57 g/mol
Molecular Formula C27H22N6O2S
Exact Mass 494.152495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E1bgLEg9YiJ
Name 6-(2-Carbethoxymethyl-imidazo[1,2-a]pyrimidin-7-yl)-5-(1-pyrrolyl)-4-methyl-2-phenylthieno[2,3-d]pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H22N6O2S
InChI InChI=1S/C27H22N6O2S/c1-3-35-21(34)15-19-16-33-14-11-20(30-27(33)29-19)24-23(32-12-7-8-13-32)22-17(2)28-25(31-26(22)36-24)18-9-5-4-6-10-18/h4-14,16H,3,15H2,1-2H3
InChIKey UMFQFJCVNUOVLE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200700154
Molecular Weight 494.573 g/mol
SMILES c1(nc2c(c(n1)C)c(c(s2)C1=Nc2[n](C=C1)cc(n2)CC(=O)OCC)-[n]1cccc1)-c1ccccc1
SPLASH splash10-001i-1109100000-a30544b3d3c4a93a248b
Source of Spectrum QA-54-1083-17c
Synonyms Ethyl 2-(7-(4-methyl-2-phenyl-5-(1H-pyrrol-1-yl)thieno[2,3-d]pyrimidin-6-yl)imidazo[1,2-a]pyrimidin-2-yl)acetate
Wiley ID 1796312