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4-keto-5-methyl-3-(2-pyrrolidinoethyl)-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester
SpectraBase Compound ID CG7yXAG75sL
InChI InChI=1S/C15H19N3O3S2/c1-9-10-12(23-11(9)14(20)21-2)16-15(22)18(13(10)19)8-7-17-5-3-4-6-17/h3-8H2,1-2H3,(H,16,22)
InChIKey VATDHXJRMOGDST-UHFFFAOYSA-N
Mol Weight 353.46 g/mol
Molecular Formula C15H19N3O3S2
Exact Mass 353.086784 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EYwHVk5FKRy
Name 4-keto-5-methyl-3-(2-pyrrolidinoethyl)-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19N3O3S2
InChI InChI=1S/C15H19N3O3S2/c1-9-10-12(23-11(9)14(20)21-2)16-15(22)18(13(10)19)8-7-17-5-3-4-6-17/h3-8H2,1-2H3,(H,16,22)
InChIKey VATDHXJRMOGDST-UHFFFAOYSA-N
Molecular Weight 353.455 g/mol
SMILES N1C(N(C(c2c1sc(c2C)C(=O)OC)=O)CCN1CCCC1)=S
SPLASH splash10-001i-9000000000-fca5e001a8603b0b00d7
Source of Spectrum AD-0-2532-0
Synonyms 5-Methyl-4-oxo-3-[2-(1-pyrrolidinyl)ethyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Methyl 5-methyl-4-oxidanylidene-3-(2-pyrrolidin-1-ylethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylate Methyl 5-methyl-4-oxo-3-(2-pyrrolidin-1-ylethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylate Methyl 5-methyl-4-oxo-3-(2-pyrrolidin-1-ylethyl)-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylate Thieno[2,3-d]pyrimidine-6-carboxylic acid, 5-methyl-4-oxo-3-[2-(pyrrolidin-1-yl)ethyl]-2-thioxo-1,2,3,4-tetrahydro-, methyl ester
Wiley ID 1436069