ethyl 2,5-dimethyl-4-[(2-pyrazol-1-ylpyridin-3-yl)methylamino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[(2-pyrazol-1-ylpyridin-3-yl)methylamino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[(2-pyrazol-1-yl-3-pyridyl)methylamino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2,5-dimethyl-4-[[2-(1-pyrazolyl)-3-pyridinyl]methylamino]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[(2-pyrazol-1-ylpyridin-3-yl)methylamino]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2,5-dimethyl-4-[(2-pyrazol-1-yl-3-pyridyl)methylamino]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H20N6O2S MolecularWeight: 408.4768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)C)NCC3=C(N=CC=C3)N4C=CC=N4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)C)NCC3=C(N=CC=C3)N4C=CC=N4)C

InChI

InChI=1S/C20H20N6O2S/c1-4-28-20(27)16-12(2)15-17(24-13(3)25-19(15)29-16)22-11-14-7-5-8-21-18(14)26-10-6-9-23-26/h5-10H,4,11H2,1-3H3,(H,22,24,25)