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

Systemtic Name: tert-butyl 4-(5-acetyloxy-2,6-dipyrrolidin-1-yl-pyrimidin-4-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(5-acetoxy-2,6-dipyrrolidin-1-yl-pyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 4-[5-acetyloxy-2,6-bis(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-acetyloxy-2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(5-acetoxy-2,6-dipyrrolidino-pyrimidin-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C23H36N6O4 MolecularWeight: 460.56974

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(N=C(N=C1N2CCN(CC2)C(=O)OC(C)(C)C)N3CCCC3)N4CCCC4

Isomeric SMILES

CC(=O)OC1=C(N=C(N=C1N2CCN(CC2)C(=O)OC(C)(C)C)N3CCCC3)N4CCCC4

InChI

InChI=1S/C23H36N6O4/c1-17(30)32-18-19(26-9-5-6-10-26)24-21(28-11-7-8-12-28)25-20(18)27-13-15-29(16-14-27)22(31)33-23(2,3)4/h5-16H2,1-4H3