1-cyclopentyl-2-[3-(isoquinolin-5-ylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclopentyl-2-[3-(isoquinolin-5-ylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclopentyl-2-[3-(5-isoquinolylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclopentyl-2-[3-[(5-isoquinolinylamino)-oxomethyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclopentyl-2-[3-(isoquinolin-5-ylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclopentyl-2-[3-(5-isoquinolylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Formula: C29H24N4O3 MolecularWeight: 476.52586

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=CC=C4)C(=O)NC5=CC=CC6=C5C=CN=C6

Isomeric SMILES

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=CC=C4)C(=O)NC5=CC=CC6=C5C=CN=C6

InChI

InChI=1S/C29H24N4O3/c34-28(32-24-10-4-7-21-17-30-14-13-23(21)24)19-6-3-5-18(15-19)27-31-25-16-20(29(35)36)11-12-26(25)33(27)22-8-1-2-9-22/h3-7,10-17,22H,1-2,8-9H2,(H,32,34)(H,35,36)