N-[7-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1-[(4-fluorophenyl)methyl]benzimidazol-5-yl]-2-methoxy-ethanamide

Systemtic Name: N-[7-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1-[(4-fluorophenyl)methyl]benzimidazol-5-yl]-2-methoxy-ethanamide Openeye Name: N-[7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-[(4-fluorophenyl)methyl]benzimidazol-5-yl]-2-methoxy-acetamide CAS Name: N-[7-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1-[(4-fluorophenyl)methyl]-5-benzimidazolyl]-2-methoxyacetamide IUPAC Name: N-[7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-[(4-fluorophenyl)methyl]benzimidazol-5-yl]-2-methoxyacetamide Traditional Name: N-[7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-(4-fluorobenzyl)benzimidazol-5-yl]-2-methoxy-acetamide Formula: C27H25FN4O3 MolecularWeight: 472.510803

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)NC1=CC2=C(C(=C1)C(=O)N3CCC4=CC=CC=C4C3)N(C=N2)CC5=CC=C(C=C5)F

Isomeric SMILES

COCC(=O)NC1=CC2=C(C(=C1)C(=O)N3CCC4=CC=CC=C4C3)N(C=N2)CC5=CC=C(C=C5)F

InChI

InChI=1S/C27H25FN4O3/c1-35-16-25(33)30-22-12-23(27(34)31-11-10-19-4-2-3-5-20(19)15-31)26-24(13-22)29-17-32(26)14-18-6-8-21(28)9-7-18/h2-9,12-13,17H,10-11,14-16H2,1H3,(H,30,33)