tert-butyl 4-[3-(6-methyl-2-morpholin-4-yl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(6-methyl-2-morpholin-4-yl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-(6-methyl-2-morpholino-4-oxo-1H-pyrimidin-5-yl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-[6-methyl-2-(4-morpholinyl)-4-oxo-1H-pyrimidin-5-yl]-1-oxopropyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(6-methyl-2-morpholin-4-yl-4-oxo-1H-pyrimidin-5-yl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(4-keto-6-methyl-2-morpholino-1H-pyrimidin-5-yl)propanoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C21H33N5O5 MolecularWeight: 435.51722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N2CCOCC2)CCC(=O)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2CCOCC2)CCC(=O)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H33N5O5/c1-15-16(18(28)23-19(22-15)25-11-13-30-14-12-25)5-6-17(27)24-7-9-26(10-8-24)20(29)31-21(2,3)4/h5-14H2,1-4H3,(H,22,23,28)