4-[[5-(2,2-dimethylpropanoyl)-1-methyl-benzimidazol-2-yl]methylamino]benzenecarbonitrile

Systemtic Name: 4-[[5-(2,2-dimethylpropanoyl)-1-methyl-benzimidazol-2-yl]methylamino]benzenecarbonitrile Openeye Name: 4-[[5-(2,2-dimethylpropanoyl)-1-methyl-benzimidazol-2-yl]methylamino]benzonitrile CAS Name: 4-[[5-(2,2-dimethyl-1-oxopropyl)-1-methyl-2-benzimidazolyl]methylamino]benzonitrile IUPAC Name: 4-[[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]methylamino]benzonitrile Traditional Name: 4-[(1-methyl-5-pivaloyl-benzimidazol-2-yl)methylamino]benzonitrile Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=CC2=C(C=C1)N(C(=N2)CNC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC(C)(C)C(=O)C1=CC2=C(C=C1)N(C(=N2)CNC3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C21H22N4O/c1-21(2,3)20(26)15-7-10-18-17(11-15)24-19(25(18)4)13-23-16-8-5-14(12-22)6-9-16/h5-11,23H,13H2,1-4H3