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

*Links on SpectraBase are not permalinks.
1,3-bis(4-chlorophenyl)-4-keto-2-thioxo-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester
SpectraBase Compound ID H5EK0LmpHE0
InChI InChI=1S/C20H12Cl2N2O3S2/c1-27-19(26)16-10-15-17(25)23(13-6-2-11(21)3-7-13)20(28)24(18(15)29-16)14-8-4-12(22)5-9-14/h2-10H,1H3
InChIKey RDIDYEJOQXLFPZ-UHFFFAOYSA-N
Mol Weight 463.35 g/mol
Molecular Formula C20H12Cl2N2O3S2
Exact Mass 461.96664 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 4A1Gq2GEuOZ
Name 1,3-bis(4-chlorophenyl)-4-keto-2-thioxo-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H12Cl2N2O3S2
InChI InChI=1S/C20H12Cl2N2O3S2/c1-27-19(26)16-10-15-17(25)23(13-6-2-11(21)3-7-13)20(28)24(18(15)29-16)14-8-4-12(22)5-9-14/h2-10H,1H3
InChIKey RDIDYEJOQXLFPZ-UHFFFAOYSA-N
Molecular Weight 463.353 g/mol
SMILES C1(N(c2c(C(N1c1ccc(cc1)Cl)=O)cc(s2)C(=O)OC)c1ccc(cc1)Cl)=S
SPLASH splash10-0007-0091400000-20500450b4a5a0be5c48
Source of Spectrum Y1-35-716-5
Synonyms 1,3-bis(4-chlorophenyl)-4-oxo-2-sulfanylidene-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester Methyl 1,3-bis(4-chlorophenyl)-4-oxidanylidene-2-sulfanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Methyl 1,3-bis(4-chlorophenyl)-4-oxo-2-sulfanylidenethieno[2,3-d]pyrimidine-6-carboxylate Methyl 1,3-bis(4-chlorophenyl)-4-oxo-2-thioxo-thieno[2,3-d]pyrimidine-6-carboxylate
Wiley ID 1526774