tert-butyl 4-[[methyl-[6-[[4-[(2-oxidanylidene-1,3-oxazolidin-4-yl)methyl]phenyl]amino]pyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[methyl-[6-[[4-[(2-oxidanylidene-1,3-oxazolidin-4-yl)methyl]phenyl]amino]pyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[methyl-[6-[4-[(2-oxooxazolidin-4-yl)methyl]anilino]pyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[methyl-[6-[4-[(2-oxo-4-oxazolidinyl)methyl]anilino]-4-pyrimidinyl]amino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[methyl-[6-[4-[(2-oxo-1,3-oxazolidin-4-yl)methyl]anilino]pyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[[6-[4-[(2-ketooxazolidin-4-yl)methyl]anilino]pyrimidin-4-yl]-methyl-amino]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H36N6O4 MolecularWeight: 496.60184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CN(C)C2=NC=NC(=C2)NC3=CC=C(C=C3)CC4COC(=O)N4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CN(C)C2=NC=NC(=C2)NC3=CC=C(C=C3)CC4COC(=O)N4

InChI

InChI=1S/C26H36N6O4/c1-26(2,3)36-25(34)32-11-9-19(10-12-32)15-31(4)23-14-22(27-17-28-23)29-20-7-5-18(6-8-20)13-21-16-35-24(33)30-21/h5-8,14,17,19,21H,9-13,15-16H2,1-4H3,(H,30,33)(H,27,28,29)