2-[1-[3-(4-ethanoylpiperazin-1-yl)phenyl]benzimidazol-5-yl]ethanenitrile

Systemtic Name: 2-[1-[3-(4-ethanoylpiperazin-1-yl)phenyl]benzimidazol-5-yl]ethanenitrile Openeye Name: 2-[1-[3-(4-acetylpiperazin-1-yl)phenyl]benzimidazol-5-yl]acetonitrile CAS Name: 2-[1-[3-(4-acetyl-1-piperazinyl)phenyl]-5-benzimidazolyl]acetonitrile IUPAC Name: 2-[1-[3-(4-acetylpiperazin-1-yl)phenyl]benzimidazol-5-yl]acetonitrile Traditional Name: 2-[1-[3-(4-acetylpiperazino)phenyl]benzimidazol-5-yl]acetonitrile Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC=CC(=C2)N3C=NC4=C3C=CC(=C4)CC#N

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC=CC(=C2)N3C=NC4=C3C=CC(=C4)CC#N

InChI

InChI=1S/C21H21N5O/c1-16(27)24-9-11-25(12-10-24)18-3-2-4-19(14-18)26-15-23-20-13-17(7-8-22)5-6-21(20)26/h2-6,13-15H,7,9-12H2,1H3