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

Systemtic Name: ethyl 2-[[4-(diethylamino)-5-methyl-thieno[2,3-d]pyrimidin-6-yl]carbonylamino]benzoate Openeye Name: ethyl 2-[[4-(diethylamino)-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]amino]benzoate CAS Name: 2-[[[4-(diethylamino)-5-methyl-6-thieno[2,3-d]pyrimidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[4-(diethylamino)-5-methylthieno[2,3-d]pyrimidine-6-carbonyl]amino]benzoate Traditional Name: 2-[[4-(diethylamino)-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]amino]benzoic acid ethyl ester Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C2C(=C(SC2=NC=N1)C(=O)NC3=CC=CC=C3C(=O)OCC)C

Isomeric SMILES

CCN(CC)C1=C2C(=C(SC2=NC=N1)C(=O)NC3=CC=CC=C3C(=O)OCC)C

InChI

InChI=1S/C21H24N4O3S/c1-5-25(6-2)18-16-13(4)17(29-20(16)23-12-22-18)19(26)24-15-11-9-8-10-14(15)21(27)28-7-3/h8-12H,5-7H2,1-4H3,(H,24,26)