tert-butyl 4-[5-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-2,6-dipyrrolidin-1-yl-pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-2,6-dipyrrolidin-1-yl-pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[5-(2,5-dioxopyrrolidin-1-yl)-2,6-dipyrrolidin-1-yl-pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[5-(2,5-dioxo-1-pyrrolidinyl)-2,6-bis(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-(2,5-dioxopyrrolidin-1-yl)-2,6-dipyrrolidin-1-ylpyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-(2,6-dipyrrolidino-5-succinimido-pyrimidin-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C25H37N7O4 MolecularWeight: 499.60578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC(=C2N3C(=O)CCC3=O)N4CCCC4)N5CCCC5

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC(=C2N3C(=O)CCC3=O)N4CCCC4)N5CCCC5

InChI

InChI=1S/C25H37N7O4/c1-25(2,3)36-24(35)31-16-14-29(15-17-31)22-20(32-18(33)8-9-19(32)34)21(28-10-4-5-11-28)26-23(27-22)30-12-6-7-13-30/h4-17H2,1-3H3