For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-(4-Chlorophenyl)-3,4-dihydro-2-(2,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-6-carboxamide
SpectraBase Compound ID 7u6WwCQzka2
InChI InChI=1S/C21H16ClN3O4S/c1-28-12-7-8-13(14(9-12)29-2)19-24-20(27)16-15(10-3-5-11(22)6-4-10)17(18(23)26)30-21(16)25-19/h3-9H,1-2H3,(H2,23,26)(H,24,25,27)
InChIKey ZGVQSELSSQUYQA-UHFFFAOYSA-N
Mol Weight 441.89 g/mol
Molecular Formula C21H16ClN3O4S
Exact Mass 441.055005 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AJy7juyWPg1
Name 5-(4-Chlorophenyl)-3,4-dihydro-2-(2,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-6-carboxamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16ClN3O4S
InChI InChI=1S/C21H16ClN3O4S/c1-28-12-7-8-13(14(9-12)29-2)19-24-20(27)16-15(10-3-5-11(22)6-4-10)17(18(23)26)30-21(16)25-19/h3-9H,1-2H3,(H2,23,26)(H,24,25,27)
InChIKey ZGVQSELSSQUYQA-UHFFFAOYSA-N
Molecular Weight 441.889 g/mol
SMILES NC(c1c(c2c(N=C(NC2=O)c2c(cc(cc2)OC)OC)s1)-c1ccc(cc1)Cl)=O
SPLASH splash10-0006-0000900000-7eef044edcb1dc72b3b7
Source of Spectrum Y-49-367-9b
Wiley ID 1706562