3-[2-(diethylamino)-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 3-[2-(diethylamino)-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 3-[2-(diethylamino)-2-oxo-ethyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[2-(diethylamino)-2-oxoethyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 3-[2-(diethylamino)-2-oxoethyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[2-(diethylamino)-2-keto-ethyl]-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C14H16N3O4S- MolecularWeight: 322.35954

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN1C=NC2=C(C1=O)C(=C(S2)C(=O)[O-])C

Isomeric SMILES

CCN(CC)C(=O)CN1C=NC2=C(C1=O)C(=C(S2)C(=O)[O-])C

InChI

InChI=1S/C14H17N3O4S/c1-4-16(5-2)9(18)6-17-7-15-12-10(13(17)19)8(3)11(22-12)14(20)21/h7H,4-6H2,1-3H3,(H,20,21)/p-1