N-(1-adamantyl)-4-piperazin-1-yl-6-pyrrolidin-1-yl-pyrimidin-2-amine

Systemtic Name: N-(1-adamantyl)-4-piperazin-1-yl-6-pyrrolidin-1-yl-pyrimidin-2-amine Openeye Name: N-(1-adamantyl)-4-piperazin-1-yl-6-pyrrolidin-1-yl-pyrimidin-2-amine CAS Name: N-(1-adamantyl)-4-(1-piperazinyl)-6-(1-pyrrolidinyl)-2-pyrimidinamine IUPAC Name: N-(1-adamantyl)-4-piperazin-1-yl-6-pyrrolidin-1-ylpyrimidin-2-amine Traditional Name: 1-adamantyl-(4-piperazino-6-pyrrolidino-pyrimidin-2-yl)amine Formula: C22H34N6 MolecularWeight: 382.54556

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC(=N2)NC34CC5CC(C3)CC(C5)C4)N6CCNCC6

Isomeric SMILES

C1CCN(C1)C2=CC(=NC(=N2)NC34CC5CC(C3)CC(C5)C4)N6CCNCC6

InChI

InChI=1S/C22H34N6/c1-2-6-27(5-1)19-12-20(28-7-3-23-4-8-28)25-21(24-19)26-22-13-16-9-17(14-22)11-18(10-16)15-22/h12,16-18,23H,1-11,13-15H2,(H,24,25,26)