pyrrolidin-2-ylmethyl 4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carboxylate

Systemtic Name: pyrrolidin-2-ylmethyl 4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carboxylate Openeye Name: pyrrolidin-2-ylmethyl 4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 4-[2,6-bis(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinecarboxylic acid 2-pyrrolidinylmethyl ester IUPAC Name: pyrrolidin-2-ylmethyl 4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(2,6-dipyrrolidinopyrimidin-4-yl)piperazine-1-carboxylic acid pyrrolidin-2-ylmethyl ester Formula: C22H35N7O2 MolecularWeight: 429.559

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC(=N2)N3CCCC3)N4CCN(CC4)C(=O)OCC5CCCN5

Isomeric SMILES

C1CCN(C1)C2=CC(=NC(=N2)N3CCCC3)N4CCN(CC4)C(=O)OCC5CCCN5

InChI

InChI=1S/C22H35N7O2/c30-22(31-17-18-6-5-7-23-18)29-14-12-27(13-15-29)20-16-19(26-8-1-2-9-26)24-21(25-20)28-10-3-4-11-28/h16,18,23H,1-15,17H2