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5-(2-Chloroacetamido)-4-phenyl-2-(p-tolylamino)thieno[2,3-d]pyrimidine-6-carboxamide
SpectraBase Compound ID Ck7Hw4RKjN
InChI InChI=1S/C22H18ClN5O2S/c1-12-7-9-14(10-8-12)25-22-27-17(13-5-3-2-4-6-13)16-18(26-15(29)11-23)19(20(24)30)31-21(16)28-22/h2-10H,11H2,1H3,(H2,24,30)(H,26,29)(H,25,27,28)
InChIKey OVCPPQXVVNVMDV-UHFFFAOYSA-N
Mol Weight 451.93 g/mol
Molecular Formula C22H18ClN5O2S
Exact Mass 451.086974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fge4qUchh
Name 5-(2-Chloroacetamido)-4-phenyl-2-(p-tolylamino)thieno[2,3-d]pyrimidine-6-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18ClN5O2S
InChI InChI=1S/C22H18ClN5O2S/c1-12-7-9-14(10-8-12)25-22-27-17(13-5-3-2-4-6-13)16-18(26-15(29)11-23)19(20(24)30)31-21(16)28-22/h2-10H,11H2,1H3,(H2,24,30)(H,26,29)(H,25,27,28)
InChIKey OVCPPQXVVNVMDV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.201800292
Molecular Weight 451.932 g/mol
SMILES N(c1nc(c2c(sc(c2NC(CCl)=O)C(=O)N)n1)-c1ccccc1)c1ccc(cc1)C
SPLASH splash10-0hji-5923800000-1dfc5e8c3d2727b7d191
Source of Spectrum QA-66-SM8-5
Wiley ID 1819625