1-cyclohexyl-2-[2-(1-phenylpyrazol-4-yl)quinolin-6-yl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[2-(1-phenylpyrazol-4-yl)quinolin-6-yl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[2-(1-phenylpyrazol-4-yl)-6-quinolyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[2-(1-phenyl-4-pyrazolyl)-6-quinolinyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[2-(1-phenylpyrazol-4-yl)quinolin-6-yl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[2-(1-phenylpyrazol-4-yl)-6-quinolyl]benzimidazole-5-carboxylic acid Formula: C32H27N5O2 MolecularWeight: 513.58908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC5=C(C=C4)N=C(C=C5)C6=CN(N=C6)C7=CC=CC=C7

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC5=C(C=C4)N=C(C=C5)C6=CN(N=C6)C7=CC=CC=C7

InChI

InChI=1S/C32H27N5O2/c38-32(39)23-13-16-30-29(18-23)35-31(37(30)26-9-5-2-6-10-26)22-12-15-27-21(17-22)11-14-28(34-27)24-19-33-36(20-24)25-7-3-1-4-8-25/h1,3-4,7-8,11-20,26H,2,5-6,9-10H2,(H,38,39)