1-cyclohexyl-2-[4-(3-imidazol-1-ylpropylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[4-(3-imidazol-1-ylpropylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[4-(3-imidazol-1-ylpropylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[4-[[3-(1-imidazolyl)propylamino]-oxomethyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[4-(3-imidazol-1-ylpropylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[4-(3-imidazol-1-ylpropylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Formula: C27H29N5O3 MolecularWeight: 471.55086

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)C(=O)NCCCN5C=CN=C5

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)C(=O)NCCCN5C=CN=C5

InChI

InChI=1S/C27H29N5O3/c33-26(29-13-4-15-31-16-14-28-18-31)20-9-7-19(8-10-20)25-30-23-17-21(27(34)35)11-12-24(23)32(25)22-5-2-1-3-6-22/h7-12,14,16-18,22H,1-6,13,15H2,(H,29,33)(H,34,35)