N-[3-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]propyl]-4-methoxy-benzamide

Systemtic Name: N-[3-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]propyl]-4-methoxy-benzamide Openeye Name: N-[3-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]propyl]-4-methoxy-benzamide CAS Name: N-[3-[1-[3-(1-azepanyl)-3-oxopropyl]-2-benzimidazolyl]propyl]-4-methoxybenzamide IUPAC Name: N-[3-[1-[3-(azepan-1-yl)-3-oxopropyl]benzimidazol-2-yl]propyl]-4-methoxybenzamide Traditional Name: N-[3-[1-[3-(azepan-1-yl)-3-keto-propyl]benzimidazol-2-yl]propyl]-4-methoxy-benzamide Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCCCC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NCCCC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4

InChI

InChI=1S/C27H34N4O3/c1-34-22-14-12-21(13-15-22)27(33)28-17-8-11-25-29-23-9-4-5-10-24(23)31(25)20-16-26(32)30-18-6-2-3-7-19-30/h4-5,9-10,12-15H,2-3,6-8,11,16-20H2,1H3,(H,28,33)