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

Systemtic Name: 2-(4-methoxyphenyl)-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 2-(4-methoxyphenyl)-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 2-(4-methoxyphenyl)-4,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 2-(4-methoxyphenyl)-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 2-(4-methoxyphenyl)-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)C)C3=CC=C(C=C3)OC)C(=O)O

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)C)C3=CC=C(C=C3)OC)C(=O)O

InChI

InChI=1S/C16H14N2O3S/c1-8-12-9(2)17-14(10-4-6-11(21-3)7-5-10)18-15(12)22-13(8)16(19)20/h4-7H,1-3H3,(H,19,20)