1-cyclohexyl-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)quinolin-6-yl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)quinolin-6-yl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-6-quinolyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-6-quinolinyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)quinolin-6-yl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-6-quinolyl]benzimidazole-5-carboxylic acid Formula: C34H31N5O2 MolecularWeight: 541.64224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3=NC4=C(C=C3)C=C(C=C4)C5=NC6=C(N5C7CCCCC7)C=CC(=C6)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3=NC4=C(C=C3)C=C(C=C4)C5=NC6=C(N5C7CCCCC7)C=CC(=C6)C(=O)O

InChI

InChI=1S/C34H31N5O2/c1-21-32(22(2)39(37-21)27-11-7-4-8-12-27)29-17-13-23-19-24(14-16-28(23)35-29)33-36-30-20-25(34(40)41)15-18-31(30)38(33)26-9-5-3-6-10-26/h4,7-8,11-20,26H,3,5-6,9-10H2,1-2H3,(H,40,41)