ethyl 1-ethyl-3-methyl-2,4-bis(oxidanylidene)-6-(quinolin-4-ylmethyl)thieno[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-ethyl-3-methyl-2,4-bis(oxidanylidene)-6-(quinolin-4-ylmethyl)thieno[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 1-ethyl-3-methyl-2,4-dioxo-6-(4-quinolylmethyl)thieno[2,3-d]pyrimidine-5-carboxylate CAS Name: 1-ethyl-3-methyl-2,4-dioxo-6-(4-quinolinylmethyl)-5-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-3-methyl-2,4-dioxo-6-(quinolin-4-ylmethyl)thieno[2,3-d]pyrimidine-5-carboxylate Traditional Name: 1-ethyl-2,4-diketo-3-methyl-6-(4-quinolylmethyl)thieno[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=C(S2)CC3=CC=NC4=CC=CC=C34)C(=O)OCC)C(=O)N(C1=O)C

Isomeric SMILES

CCN1C2=C(C(=C(S2)CC3=CC=NC4=CC=CC=C34)C(=O)OCC)C(=O)N(C1=O)C

InChI

InChI=1S/C22H21N3O4S/c1-4-25-20-18(19(26)24(3)22(25)28)17(21(27)29-5-2)16(30-20)12-13-10-11-23-15-9-7-6-8-14(13)15/h6-11H,4-5,12H2,1-3H3