7-acetamido-N-[(3S)-2-oxidanylideneazepan-3-yl]-1-(2-pyridin-2-ylethyl)benzimidazole-5-carboxamide

Systemtic Name: 7-acetamido-N-[(3S)-2-oxidanylideneazepan-3-yl]-1-(2-pyridin-2-ylethyl)benzimidazole-5-carboxamide Openeye Name: 7-acetamido-N-[(3S)-2-oxoazepan-3-yl]-1-[2-(2-pyridyl)ethyl]benzimidazole-5-carboxamide CAS Name: 7-acetamido-N-[(3S)-2-oxo-3-azepanyl]-1-[2-(2-pyridinyl)ethyl]-5-benzimidazolecarboxamide IUPAC Name: 7-acetamido-N-[(3S)-2-oxoazepan-3-yl]-1-(2-pyridin-2-ylethyl)benzimidazole-5-carboxamide Traditional Name: 7-acetamido-N-[(3S)-2-ketoazepan-3-yl]-1-[2-(2-pyridyl)ethyl]benzimidazole-5-carboxamide Formula: C23H26N6O3 MolecularWeight: 434.49094

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC2=C1N(C=N2)CCC3=CC=CC=N3)C(=O)NC4CCCCNC4=O

Isomeric SMILES

CC(=O)NC1=CC(=CC2=C1N(C=N2)CCC3=CC=CC=N3)C(=O)N[C@H]4CCCCNC4=O

InChI

InChI=1S/C23H26N6O3/c1-15(30)27-20-13-16(22(31)28-18-7-3-5-10-25-23(18)32)12-19-21(20)29(14-26-19)11-8-17-6-2-4-9-24-17/h2,4,6,9,12-14,18H,3,5,7-8,10-11H2,1H3,(H,25,32)(H,27,30)(H,28,31)/t18-/m0/s1