3-[[(6-bromanyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]methyl]benzenecarbonitrile

Systemtic Name: 3-[[(6-bromanyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]methyl]benzenecarbonitrile Openeye Name: 3-[[(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]methyl]benzonitrile CAS Name: 3-[[(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]methyl]benzonitrile IUPAC Name: 3-[[(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]methyl]benzonitrile Traditional Name: 3-[[(6-bromo-2-keto-1,3-dihydrobenzimidazol-5-yl)amino]methyl]benzonitrile Formula: C15H11BrN4O MolecularWeight: 343.17804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CNC2=C(C=C3C(=C2)NC(=O)N3)Br)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CNC2=C(C=C3C(=C2)NC(=O)N3)Br)C#N

InChI

InChI=1S/C15H11BrN4O/c16-11-5-13-14(20-15(21)19-13)6-12(11)18-8-10-3-1-2-9(4-10)7-17/h1-6,18H,8H2,(H2,19,20,21)