methyl 2-[[3-(2-ethoxyethyl)-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[3-(2-ethoxyethyl)-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[3-(2-ethoxyethyl)-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carbonyl]amino]benzoate CAS Name: 2-[[[3-(2-ethoxyethyl)-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[3-(2-ethoxyethyl)-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carbonyl]amino]benzoate Traditional Name: 2-[[3-(2-ethoxyethyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]amino]benzoic acid methyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC=CC=C3C(=O)OC)C

Isomeric SMILES

CCOCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC=CC=C3C(=O)OC)C

InChI

InChI=1S/C20H21N3O5S/c1-4-28-10-9-23-11-21-18-15(19(23)25)12(2)16(29-18)17(24)22-14-8-6-5-7-13(14)20(26)27-3/h5-8,11H,4,9-10H2,1-3H3,(H,22,24)