2,5-dimethyl-4-(2-pyridin-2-ylethylamino)thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 2,5-dimethyl-4-(2-pyridin-2-ylethylamino)thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 2,5-dimethyl-4-[2-(2-pyridyl)ethylamino]thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 2,5-dimethyl-4-[2-(2-pyridinyl)ethylamino]-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 2,5-dimethyl-4-(2-pyridin-2-ylethylamino)thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 2,5-dimethyl-4-[2-(2-pyridyl)ethylamino]thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NCCC3=CC=CC=N3)C)C(=O)O

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NCCC3=CC=CC=N3)C)C(=O)O

InChI

InChI=1S/C16H16N4O2S/c1-9-12-14(18-8-6-11-5-3-4-7-17-11)19-10(2)20-15(12)23-13(9)16(21)22/h3-5,7H,6,8H2,1-2H3,(H,21,22)(H,18,19,20)