3-(thieno[3,2-d]pyrimidin-4-ylamino)benzoic acid

Systemtic Name: 3-(thieno[3,2-d]pyrimidin-4-ylamino)benzoic acid Openeye Name: 3-(thieno[3,2-d]pyrimidin-4-ylamino)benzoic acid CAS Name: 3-(4-thieno[3,2-d]pyrimidinylamino)benzoic acid IUPAC Name: 3-(thieno[3,2-d]pyrimidin-4-ylamino)benzoic acid Traditional Name: 3-(thieno[3,2-d]pyrimidin-4-ylamino)benzoic acid Formula: C13H9N3O2S MolecularWeight: 271.29446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC=NC3=C2SC=C3)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC=NC3=C2SC=C3)C(=O)O

InChI

InChI=1S/C13H9N3O2S/c17-13(18)8-2-1-3-9(6-8)16-12-11-10(4-5-19-11)14-7-15-12/h1-7H,(H,17,18)(H,14,15,16)