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

Systemtic Name: 4-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]benzoic acid Openeye Name: 4-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]benzoic acid CAS Name: 4-[2-(4-thieno[3,2-d]pyrimidinylamino)ethyl]benzoic acid IUPAC Name: 4-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]benzoic acid Traditional Name: 4-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]benzoic acid Formula: C15H13N3O2S MolecularWeight: 299.34762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC2=NC=NC3=C2SC=C3)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCNC2=NC=NC3=C2SC=C3)C(=O)O

InChI

InChI=1S/C15H13N3O2S/c19-15(20)11-3-1-10(2-4-11)5-7-16-14-13-12(6-8-21-13)17-9-18-14/h1-4,6,8-9H,5,7H2,(H,19,20)(H,16,17,18)