4-[[2-[4-[methyl-(6-oxidanylidene-1H-pyrimidin-2-yl)amino]piperidin-1-yl]benzimidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[2-[4-[methyl-(6-oxidanylidene-1H-pyrimidin-2-yl)amino]piperidin-1-yl]benzimidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[2-[4-[methyl-(6-oxo-1H-pyrimidin-2-yl)amino]-1-piperidyl]benzimidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[2-[4-[methyl-(6-oxo-1H-pyrimidin-2-yl)amino]-1-piperidinyl]-1-benzimidazolyl]methyl]benzonitrile IUPAC Name: 4-[[2-[4-[methyl-(6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]benzimidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[2-[4-[(6-keto-1H-pyrimidin-2-yl)-methyl-amino]piperidino]benzimidazol-1-yl]methyl]benzonitrile Formula: C25H25N7O MolecularWeight: 439.5123

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(CC1)C2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)C#N)C5=NC=CC(=O)N5

Isomeric SMILES

CN(C1CCN(CC1)C2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)C#N)C5=NC=CC(=O)N5

InChI

InChI=1S/C25H25N7O/c1-30(24-27-13-10-23(33)29-24)20-11-14-31(15-12-20)25-28-21-4-2-3-5-22(21)32(25)17-19-8-6-18(16-26)7-9-19/h2-10,13,20H,11-12,14-15,17H2,1H3,(H,27,29,33)