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2-[(2-{[3-(ethoxycarbonyl)-4,5-dimethylthiophen-2-yl]amino}-2-oxoethyl)sulfanyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylic acid

Catalog ID
STL079619
SMILES CCOC(=O)c1c(NC(=O)CSc2[nH]c(=O)c3c(n2)sc(c3C)C(=O)O)sc(c1C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C19H19N3O6S3 MW 481.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O6S3/c1-5-28-18(27)12-7(2)9(4)30-16(12)20-10(23)6-29-19-21-14(24)11-8(3)13(17(25)26)31-15(11)22-19/h5-6H2,1-4H3,(H,20,23)(H,25,26)(H,21,22,24)
InChIKey
ZLLXJYWNLYZIJS-UHFFFAOYSA-N
Synonyms
838253-02-4
2((2((3(ethoxycarbonyl)45dimethylthiophen2yl)amino)2oxoethyl)sulfanyl)5methyl4oxo34dihydrothieno(23d)pyrimidine6carboxylicacid
2((2((3(ETHOXYCARBONYL)45DIMETHYLTHIOPHEN2YL)AMINO)2OXOETHYL)THIO)5METHYL4OXO34DIHYDROTHIENO(23D)PYRIMIDINE6CARBOXYLICACID
2((N(3(ETHOXYCARBONYL)45DIMETHYL(2THIENYL))CARBAMOYL)METHYLTHIO)5METHYL4OXO3HYDROTHIOPHENO(23D)PYRIMIDINE6CARBOXYLICACID
2(2((3ETHOXYCARBONYL45DIMETHYLTHIOPHEN2YL)AMINO)2OXOETHYL)SULFANYL5METHYL4OXO3HTHIENO(23D)PYRIMIDINE6CARBOXYLICACID
838253024
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NC3=C(C(=C(S3)C(=O)O)C)C(=O)N2
CCOC(=O)c1c(NC(=O)CSc2(nH)c(=O)c3c(n2)sc(c3C)C(=O)O)sc(c1C)C
InChI=1SC19H19N3O6S3c152818(27)127(2)9(4)3016(12)2010(23)629192114(24)118(3)13(17(25)26)3115(11)2219h56H214H3(H2023)(H2526)(H212224)
MFCD05841210
ZINC000002709280
ZINC2709280

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Available files

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