ethyl 5-methyl-2-[1-(1-methylsulfonylpyrrolidin-2-yl)carbonyloxyethyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-2-[1-(1-methylsulfonylpyrrolidin-2-yl)carbonyloxyethyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-2-[1-(1-methylsulfonylpyrrolidine-2-carbonyl)oxyethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-[1-[(1-methylsulfonyl-2-pyrrolidinyl)-oxomethoxy]ethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-[1-(1-methylsulfonylpyrrolidine-2-carbonyl)oxyethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-2-[1-(1-mesylprolyl)oxyethyl]-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C18H23N3O7S2 MolecularWeight: 457.52112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)C(C)OC(=O)C3CCCN3S(=O)(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)C(C)OC(=O)C3CCCN3S(=O)(=O)C)C

InChI

InChI=1S/C18H23N3O7S2/c1-5-27-18(24)13-9(2)12-15(22)19-14(20-16(12)29-13)10(3)28-17(23)11-7-6-8-21(11)30(4,25)26/h10-11H,5-8H2,1-4H3,(H,19,20,22)