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

Systemtic Name: tert-butyl 4-[[[6-[(2,6-dimethoxypyridin-3-yl)amino]pyrimidin-4-yl]-methyl-amino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[[6-[(2,6-dimethoxy-3-pyridyl)amino]pyrimidin-4-yl]-methyl-amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[6-[(2,6-dimethoxy-3-pyridinyl)amino]-4-pyrimidinyl]-methylamino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[[6-[(2,6-dimethoxypyridin-3-yl)amino]pyrimidin-4-yl]-methylamino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[[6-[(2,6-dimethoxy-3-pyridyl)amino]pyrimidin-4-yl]-methyl-amino]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H34N6O4 MolecularWeight: 458.55386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H34N6O4/c1-23(2,3)33-22(30)29-11-9-16(10-12-29)14-28(4)19-13-18(24-15-25-19)26-17-7-8-20(31-5)27-21(17)32-6/h7-8,13,15-16H,9-12,14H2,1-6H3,(H,24,25,26)