propan-2-yl 4-[6-[[6-(hydroxymethyl)-4-methyl-pyridin-3-yl]amino]-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[6-[[6-(hydroxymethyl)-4-methyl-pyridin-3-yl]amino]-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylate Openeye Name: isopropyl 4-[6-[[6-(hydroxymethyl)-4-methyl-3-pyridyl]amino]-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[6-[[6-(hydroxymethyl)-4-methyl-3-pyridinyl]amino]-5-methoxy-4-pyrimidinyl]oxy]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[6-[[6-(hydroxymethyl)-4-methylpyridin-3-yl]amino]-5-methoxypyrimidin-4-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[5-methoxy-6-[(4-methyl-6-methylol-3-pyridyl)amino]pyrimidin-4-yl]oxypiperidine-1-carboxylic acid isopropyl ester Formula: C21H29N5O5 MolecularWeight: 431.48546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1NC2=C(C(=NC=N2)OC3CCN(CC3)C(=O)OC(C)C)OC)CO

Isomeric SMILES

CC1=CC(=NC=C1NC2=C(C(=NC=N2)OC3CCN(CC3)C(=O)OC(C)C)OC)CO

InChI

InChI=1S/C21H29N5O5/c1-13(2)30-21(28)26-7-5-16(6-8-26)31-20-18(29-4)19(23-12-24-20)25-17-10-22-15(11-27)9-14(17)3/h9-10,12-13,16,27H,5-8,11H2,1-4H3,(H,23,24,25)