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

Systemtic Name: 4-[(thieno[2,3-d]pyrimidin-4-ylamino)methyl]benzoic acid Openeye Name: 4-[(thieno[2,3-d]pyrimidin-4-ylamino)methyl]benzoic acid CAS Name: 4-[(4-thieno[2,3-d]pyrimidinylamino)methyl]benzoic acid IUPAC Name: 4-[(thieno[2,3-d]pyrimidin-4-ylamino)methyl]benzoic acid Traditional Name: 4-[(thieno[2,3-d]pyrimidin-4-ylamino)methyl]benzoic acid Formula: C14H11N3O2S MolecularWeight: 285.32104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=C3C=CSC3=NC=N2)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNC2=C3C=CSC3=NC=N2)C(=O)O

InChI

InChI=1S/C14H11N3O2S/c18-14(19)10-3-1-9(2-4-10)7-15-12-11-5-6-20-13(11)17-8-16-12/h1-6,8H,7H2,(H,18,19)(H,15,16,17)