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

Systemtic Name: propan-2-yl 4-[5-methoxy-6-[(4-methyl-6-methylsulfonyl-pyridin-3-yl)amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate Openeye Name: isopropyl 4-[5-methoxy-6-[(4-methyl-6-methylsulfonyl-3-pyridyl)amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[5-methoxy-6-[(4-methyl-6-methylsulfonyl-3-pyridinyl)amino]-4-pyrimidinyl]oxy]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[5-methoxy-6-[(4-methyl-6-methylsulfonylpyridin-3-yl)amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[6-[(6-mesyl-4-methyl-3-pyridyl)amino]-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylic acid isopropyl ester Formula: C21H29N5O6S MolecularWeight: 479.54986

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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)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C21H29N5O6S/c1-13(2)31-21(27)26-8-6-15(7-9-26)32-20-18(30-4)19(23-12-24-20)25-16-11-22-17(10-14(16)3)33(5,28)29/h10-13,15H,6-9H2,1-5H3,(H,23,24,25)