6-acetamido-N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-2-methyl-3-(phenylmethyl)benzimidazole-4-carboxamide

Systemtic Name: 6-acetamido-N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-2-methyl-3-(phenylmethyl)benzimidazole-4-carboxamide Openeye Name: 6-acetamido-3-benzyl-N-[[(1S)-isochroman-1-yl]methyl]-2-methyl-benzimidazole-4-carboxamide CAS Name: 6-acetamido-N-[[(1S)-3,4-dihydro-1H-2-benzopyran-1-yl]methyl]-2-methyl-3-(phenylmethyl)-4-benzimidazolecarboxamide IUPAC Name: 6-acetamido-3-benzyl-N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-2-methylbenzimidazole-4-carboxamide Traditional Name: 6-acetamido-3-benzyl-N-[[(1S)-isochroman-1-yl]methyl]-2-methyl-benzimidazole-4-carboxamide Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=CC=CC=C3)C(=CC(=C2)NC(=O)C)C(=O)NCC4C5=CC=CC=C5CCO4

Isomeric SMILES

CC1=NC2=C(N1CC3=CC=CC=C3)C(=CC(=C2)NC(=O)C)C(=O)NC[C@@H]4C5=CC=CC=C5CCO4

InChI

InChI=1S/C28H28N4O3/c1-18-30-25-15-22(31-19(2)33)14-24(27(25)32(18)17-20-8-4-3-5-9-20)28(34)29-16-26-23-11-7-6-10-21(23)12-13-35-26/h3-11,14-15,26H,12-13,16-17H2,1-2H3,(H,29,34)(H,31,33)/t26-/m1/s1