ethyl 5-methyl-4-[[phenyl(pyridin-2-yl)methyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-[[phenyl(pyridin-2-yl)methyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-[[phenyl(2-pyridyl)methyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[[phenyl(2-pyridinyl)methyl]amino]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-[[phenyl(pyridin-2-yl)methyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-[[phenyl(2-pyridyl)methyl]amino]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC(C3=CC=CC=C3)C4=CC=CC=N4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC(C3=CC=CC=C3)C4=CC=CC=N4)C

InChI

InChI=1S/C22H20N4O2S/c1-3-28-22(27)19-14(2)17-20(24-13-25-21(17)29-19)26-18(15-9-5-4-6-10-15)16-11-7-8-12-23-16/h4-13,18H,3H2,1-2H3,(H,24,25,26)