6-acetamido-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-ethyl-3-(pyridin-3-ylmethyl)benzimidazole-4-carboxamide

Systemtic Name: 6-acetamido-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-ethyl-3-(pyridin-3-ylmethyl)benzimidazole-4-carboxamide Openeye Name: 6-acetamido-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-ethyl-3-(3-pyridylmethyl)benzimidazole-4-carboxamide CAS Name: 6-acetamido-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-ethyl-3-(3-pyridinylmethyl)-4-benzimidazolecarboxamide IUPAC Name: 6-acetamido-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-ethyl-3-(pyridin-3-ylmethyl)benzimidazole-4-carboxamide Traditional Name: 6-acetamido-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-ethyl-3-(3-pyridylmethyl)benzimidazole-4-carboxamide Formula: C27H27N5O4 MolecularWeight: 485.53438

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC3=CN=CC=C3)C(=CC(=C2)NC(=O)C)C(=O)NCC4COC5=CC=CC=C5O4

Isomeric SMILES

CCC1=NC2=C(N1CC3=CN=CC=C3)C(=CC(=C2)NC(=O)C)C(=O)NC[C@H]4COC5=CC=CC=C5O4

InChI

InChI=1S/C27H27N5O4/c1-3-25-31-22-12-19(30-17(2)33)11-21(26(22)32(25)15-18-7-6-10-28-13-18)27(34)29-14-20-16-35-23-8-4-5-9-24(23)36-20/h4-13,20H,3,14-16H2,1-2H3,(H,29,34)(H,30,33)/t20-/m0/s1