3H-benzimidazol-5-yl-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: 3H-benzimidazol-5-yl-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: 3H-benzimidazol-5-yl-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: 3H-benzimidazol-5-yl-[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: 3H-benzimidazol-5-yl-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: 3H-benzimidazol-5-yl-[4-(6-piperidinopyrimidin-4-yl)piperazino]methanone Formula: C21H25N7O MolecularWeight: 391.4695

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)N=CN5

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)N=CN5

InChI

InChI=1S/C21H25N7O/c29-21(16-4-5-17-18(12-16)23-14-22-17)28-10-8-27(9-11-28)20-13-19(24-15-25-20)26-6-2-1-3-7-26/h4-5,12-15H,1-3,6-11H2,(H,22,23)