[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate

Systemtic Name: [2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: [2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 4-(tert-butoxycarbonylamino)butanoate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid [2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: 4-(tert-butoxycarbonylamino)butyric acid [2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl] ester Formula: C19H29N5O5 MolecularWeight: 407.46406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCC(=O)OCC(=O)N1CCN(CC1)C2=NC=CC=N2

Isomeric SMILES

CC(C)(C)OC(=O)NCCCC(=O)OCC(=O)N1CCN(CC1)C2=NC=CC=N2

InChI

InChI=1S/C19H29N5O5/c1-19(2,3)29-18(27)22-7-4-6-16(26)28-14-15(25)23-10-12-24(13-11-23)17-20-8-5-9-21-17/h5,8-9H,4,6-7,10-14H2,1-3H3,(H,22,27)