tert-butyl 4-[(2-morpholin-4-ylpyridin-4-yl)methylcarbamoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(2-morpholin-4-ylpyridin-4-yl)methylcarbamoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(2-morpholino-4-pyridyl)methylcarbamoyl]piperazine-1-carboxylate CAS Name: 4-[[[2-(4-morpholinyl)-4-pyridinyl]methylamino]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2-morpholin-4-ylpyridin-4-yl)methylcarbamoyl]piperazine-1-carboxylate Traditional Name: 4-[(2-morpholino-4-pyridyl)methylcarbamoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H31N5O4 MolecularWeight: 405.49124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)NCC2=CC(=NC=C2)N3CCOCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)NCC2=CC(=NC=C2)N3CCOCC3

InChI

InChI=1S/C20H31N5O4/c1-20(2,3)29-19(27)25-8-6-24(7-9-25)18(26)22-15-16-4-5-21-17(14-16)23-10-12-28-13-11-23/h4-5,14H,6-13,15H2,1-3H3,(H,22,26)