5-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-1-prop-2-ynyl-azepan-2-one

Systemtic Name: 5-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-1-prop-2-ynyl-azepan-2-one Openeye Name: 5-[4-(1H-benzimidazol-2-yl)-1-piperidyl]-1-prop-2-ynyl-azepan-2-one CAS Name: 5-[4-(1H-benzimidazol-2-yl)-1-piperidinyl]-1-prop-2-ynyl-2-azepanone IUPAC Name: 5-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-1-prop-2-ynylazepan-2-one Traditional Name: 5-[4-(1H-benzimidazol-2-yl)piperidino]-1-propargyl-azepan-2-one Formula: C21H26N4O MolecularWeight: 350.45734

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1CCC(CCC1=O)N2CCC(CC2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

C#CCN1CCC(CCC1=O)N2CCC(CC2)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H26N4O/c1-2-12-25-15-11-17(7-8-20(25)26)24-13-9-16(10-14-24)21-22-18-5-3-4-6-19(18)23-21/h1,3-6,16-17H,7-15H2,(H,22,23)