1-cyclopentyl-2-[4-(isoquinolin-5-ylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclopentyl-2-[4-(isoquinolin-5-ylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclopentyl-2-[4-(5-isoquinolylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclopentyl-2-[4-[(5-isoquinolinylamino)-oxomethyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclopentyl-2-[4-(isoquinolin-5-ylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclopentyl-2-[4-(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=C(C=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=C(C=C4)C(=O)NC5=CC=CC6=C5C=CN=C6

InChI

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