4-[(5-thiophen-2-ylpyrimidin-2-yl)amino]benzoic acid

Systemtic Name: 4-[(5-thiophen-2-ylpyrimidin-2-yl)amino]benzoic acid Openeye Name: 4-[[5-(2-thienyl)pyrimidin-2-yl]amino]benzoic acid CAS Name: 4-[(5-thiophen-2-yl-2-pyrimidinyl)amino]benzoic acid IUPAC Name: 4-[(5-thiophen-2-ylpyrimidin-2-yl)amino]benzoic acid Traditional Name: 4-[[5-(2-thienyl)pyrimidin-2-yl]amino]benzoic acid Formula: C15H11N3O2S MolecularWeight: 297.33174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CN=C(N=C2)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CSC(=C1)C2=CN=C(N=C2)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C15H11N3O2S/c19-14(20)10-3-5-12(6-4-10)18-15-16-8-11(9-17-15)13-2-1-7-21-13/h1-9H,(H,19,20)(H,16,17,18)