N-[(3-fluoranyl-4-methyl-phenyl)methyl]-7-(2-methoxyethanoylamino)-1-phenethyl-benzimidazole-5-carboxamide

Systemtic Name: N-[(3-fluoranyl-4-methyl-phenyl)methyl]-7-(2-methoxyethanoylamino)-1-phenethyl-benzimidazole-5-carboxamide Openeye Name: N-[(3-fluoro-4-methyl-phenyl)methyl]-7-[(2-methoxyacetyl)amino]-1-phenethyl-benzimidazole-5-carboxamide CAS Name: N-[(3-fluoro-4-methylphenyl)methyl]-7-[(2-methoxy-1-oxoethyl)amino]-1-phenethyl-5-benzimidazolecarboxamide IUPAC Name: N-[(3-fluoro-4-methylphenyl)methyl]-7-[(2-methoxyacetyl)amino]-1-phenethylbenzimidazole-5-carboxamide Traditional Name: N-(3-fluoro-4-methyl-benzyl)-7-[(2-methoxyacetyl)amino]-1-phenethyl-benzimidazole-5-carboxamide Formula: C27H27FN4O3 MolecularWeight: 474.526683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C(=C2)NC(=O)COC)N(C=N3)CCC4=CC=CC=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C(=C2)NC(=O)COC)N(C=N3)CCC4=CC=CC=C4)F

InChI

InChI=1S/C27H27FN4O3/c1-18-8-9-20(12-22(18)28)15-29-27(34)21-13-23-26(24(14-21)31-25(33)16-35-2)32(17-30-23)11-10-19-6-4-3-5-7-19/h3-9,12-14,17H,10-11,15-16H2,1-2H3,(H,29,34)(H,31,33)