3-bromanyl-N-[1-ethyl-2-[(4-methylpiperazin-1-yl)methyl]benzimidazol-5-yl]benzamide

Systemtic Name: 3-bromanyl-N-[1-ethyl-2-[(4-methylpiperazin-1-yl)methyl]benzimidazol-5-yl]benzamide Openeye Name: 3-bromo-N-[1-ethyl-2-[(4-methylpiperazin-1-yl)methyl]benzimidazol-5-yl]benzamide CAS Name: 3-bromo-N-[1-ethyl-2-[(4-methyl-1-piperazinyl)methyl]-5-benzimidazolyl]benzamide IUPAC Name: 3-bromo-N-[1-ethyl-2-[(4-methylpiperazin-1-yl)methyl]benzimidazol-5-yl]benzamide Traditional Name: 3-bromo-N-[1-ethyl-2-[(4-methylpiperazino)methyl]benzimidazol-5-yl]benzamide Formula: C22H26BrN5O MolecularWeight: 456.37874

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)Br)N=C1CN4CCN(CC4)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)Br)N=C1CN4CCN(CC4)C

InChI

InChI=1S/C22H26BrN5O/c1-3-28-20-8-7-18(24-22(29)16-5-4-6-17(23)13-16)14-19(20)25-21(28)15-27-11-9-26(2)10-12-27/h4-8,13-14H,3,9-12,15H2,1-2H3,(H,24,29)