tert-butyl 4-(5-methoxy-2,6-dipyrrolidin-1-yl-pyrimidin-4-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(5-methoxy-2,6-dipyrrolidin-1-yl-pyrimidin-4-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(5-methoxy-2,6-dipyrrolidin-1-yl-pyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 4-[5-methoxy-2,6-bis(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-methoxy-2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(5-methoxy-2,6-dipyrrolidino-pyrimidin-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C22H36N6O3 MolecularWeight: 432.55964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC(=C2OC)N3CCCC3)N4CCCC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC(=C2OC)N3CCCC3)N4CCCC4

InChI

InChI=1S/C22H36N6O3/c1-22(2,3)31-21(29)28-15-13-26(14-16-28)19-17(30-4)18(25-9-5-6-10-25)23-20(24-19)27-11-7-8-12-27/h5-16H2,1-4H3