4-[6-(1,4,5,6-tetrahydropyrimidin-2-yl)-1H-benzimidazol-2-yl]benzoic acid

Systemtic Name: 4-[6-(1,4,5,6-tetrahydropyrimidin-2-yl)-1H-benzimidazol-2-yl]benzoic acid Openeye Name: 4-[6-(1,4,5,6-tetrahydropyrimidin-2-yl)-1H-benzimidazol-2-yl]benzoic acid CAS Name: 4-[6-(1,4,5,6-tetrahydropyrimidin-2-yl)-1H-benzimidazol-2-yl]benzoic acid IUPAC Name: 4-[6-(1,4,5,6-tetrahydropyrimidin-2-yl)-1H-benzimidazol-2-yl]benzoic acid Traditional Name: 4-[6-(1,4,5,6-tetrahydropyrimidin-2-yl)-1H-benzimidazol-2-yl]benzoic acid Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=NC1)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CNC(=NC1)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C18H16N4O2/c23-18(24)12-4-2-11(3-5-12)17-21-14-7-6-13(10-15(14)22-17)16-19-8-1-9-20-16/h2-7,10H,1,8-9H2,(H,19,20)(H,21,22)(H,23,24)