3-[1-[1-(2-azanylpyrimidin-5-yl)carbonylpiperidin-4-yl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[1-(2-azanylpyrimidin-5-yl)carbonylpiperidin-4-yl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[1-(2-aminopyrimidine-5-carbonyl)-4-piperidyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[1-[(2-amino-5-pyrimidinyl)-oxomethyl]-4-piperidinyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[1-(2-aminopyrimidine-5-carbonyl)piperidin-4-yl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[1-(2-aminopyrimidine-5-carbonyl)-4-piperidyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C22H27N7O2 MolecularWeight: 421.49548

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C4CCN(CC4)C(=O)C5=CN=C(N=C5)N

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C4CCN(CC4)C(=O)C5=CN=C(N=C5)N

InChI

InChI=1S/C22H27N7O2/c23-21-24-13-15(14-25-21)20(30)28-11-5-16(6-12-28)27-9-7-17(8-10-27)29-19-4-2-1-3-18(19)26-22(29)31/h1-4,13-14,16-17H,5-12H2,(H,26,31)(H2,23,24,25)