N-[(1S)-1-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]ethyl]furan-2-carboxamide

Systemtic Name: N-[(1S)-1-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]ethyl]furan-2-carboxamide Openeye Name: N-[(1S)-1-[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]ethyl]furan-2-carboxamide CAS Name: N-[(1S)-1-[1-[2-(1-azepanyl)-2-oxoethyl]-2-benzimidazolyl]ethyl]-2-furancarboxamide IUPAC Name: N-[(1S)-1-[1-[2-(azepan-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]furan-2-carboxamide Traditional Name: N-[(1S)-1-[1-[2-(azepan-1-yl)-2-keto-ethyl]benzimidazol-2-yl]ethyl]-2-furamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1CC(=O)N3CCCCCC3)NC(=O)C4=CC=CO4

Isomeric SMILES

C[C@@H](C1=NC2=CC=CC=C2N1CC(=O)N3CCCCCC3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C22H26N4O3/c1-16(23-22(28)19-11-8-14-29-19)21-24-17-9-4-5-10-18(17)26(21)15-20(27)25-12-6-2-3-7-13-25/h4-5,8-11,14,16H,2-3,6-7,12-13,15H2,1H3,(H,23,28)/t16-/m0/s1