6-acetamido-3-(2-methoxyethyl)-N-[(2S)-2-oxidanylbutyl]-2-pyridin-2-yl-benzimidazole-4-carboxamide

Systemtic Name: 6-acetamido-3-(2-methoxyethyl)-N-[(2S)-2-oxidanylbutyl]-2-pyridin-2-yl-benzimidazole-4-carboxamide Openeye Name: 6-acetamido-N-[(2S)-2-hydroxybutyl]-3-(2-methoxyethyl)-2-(2-pyridyl)benzimidazole-4-carboxamide CAS Name: 6-acetamido-N-[(2S)-2-hydroxybutyl]-3-(2-methoxyethyl)-2-(2-pyridinyl)-4-benzimidazolecarboxamide IUPAC Name: 6-acetamido-N-[(2S)-2-hydroxybutyl]-3-(2-methoxyethyl)-2-pyridin-2-ylbenzimidazole-4-carboxamide Traditional Name: 6-acetamido-N-[(2S)-2-hydroxybutyl]-3-(2-methoxyethyl)-2-(2-pyridyl)benzimidazole-4-carboxamide Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=CC(=CC2=C1N(C(=N2)C3=CC=CC=N3)CCOC)NC(=O)C)O

Isomeric SMILES

CC[C@@H](CNC(=O)C1=CC(=CC2=C1N(C(=N2)C3=CC=CC=N3)CCOC)NC(=O)C)O

InChI

InChI=1S/C22H27N5O4/c1-4-16(29)13-24-22(30)17-11-15(25-14(2)28)12-19-20(17)27(9-10-31-3)21(26-19)18-7-5-6-8-23-18/h5-8,11-12,16,29H,4,9-10,13H2,1-3H3,(H,24,30)(H,25,28)/t16-/m0/s1