7-fluoranyl-6-[(4-iodanyl-2-methyl-phenyl)amino]-1-(2-morpholin-2-ylethyl)-2-phenyl-benzimidazole-5-carboxylic acid

Systemtic Name: 7-fluoranyl-6-[(4-iodanyl-2-methyl-phenyl)amino]-1-(2-morpholin-2-ylethyl)-2-phenyl-benzimidazole-5-carboxylic acid Openeye Name: 7-fluoro-6-(4-iodo-2-methyl-anilino)-1-(2-morpholin-2-ylethyl)-2-phenyl-benzimidazole-5-carboxylic acid CAS Name: 7-fluoro-6-(4-iodo-2-methylanilino)-1-[2-(2-morpholinyl)ethyl]-2-phenyl-5-benzimidazolecarboxylic acid IUPAC Name: 7-fluoro-6-(4-iodo-2-methylanilino)-1-(2-morpholin-2-ylethyl)-2-phenylbenzimidazole-5-carboxylic acid Traditional Name: 7-fluoro-6-(4-iodo-2-methyl-anilino)-1-(2-morpholin-2-ylethyl)-2-phenyl-benzimidazole-5-carboxylic acid Formula: C27H26FIN4O3 MolecularWeight: 600.423213

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C(C3=C(C=C2C(=O)O)N=C(N3CCC4CNCCO4)C5=CC=CC=C5)F

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C3=C(C=C2C(=O)O)N=C(N3CCC4CNCCO4)C5=CC=CC=C5)F

InChI

InChI=1S/C27H26FIN4O3/c1-16-13-18(29)7-8-21(16)31-24-20(27(34)35)14-22-25(23(24)28)33(11-9-19-15-30-10-12-36-19)26(32-22)17-5-3-2-4-6-17/h2-8,13-14,19,30-31H,9-12,15H2,1H3,(H,34,35)