[1-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 2-phenyl-3H-benzimidazole-5-carboxylate

Systemtic Name: [1-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 2-phenyl-3H-benzimidazole-5-carboxylate Openeye Name: 1-[(3-chloro-4-fluoro-phenyl)carbamoyl]propyl 2-phenyl-3H-benzimidazole-5-carboxylate CAS Name: 2-phenyl-3H-benzimidazole-5-carboxylic acid [1-(3-chloro-4-fluoroanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(3-chloro-4-fluoroanilino)-1-oxobutan-2-yl] 2-phenyl-3H-benzimidazole-5-carboxylate Traditional Name: 2-phenyl-3H-benzimidazole-5-carboxylic acid 1-[(3-chloro-4-fluoro-phenyl)carbamoyl]propyl ester Formula: C24H19ClFN3O3 MolecularWeight: 451.877363

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1)F)Cl)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1)F)Cl)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C24H19ClFN3O3/c1-2-21(23(30)27-16-9-10-18(26)17(25)13-16)32-24(31)15-8-11-19-20(12-15)29-22(28-19)14-6-4-3-5-7-14/h3-13,21H,2H2,1H3,(H,27,30)(H,28,29)