tert-butyl 4-[5-ethanoyl-6-[(6-methylsulfonylpyridin-3-yl)amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-ethanoyl-6-[(6-methylsulfonylpyridin-3-yl)amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate Openeye Name: tert-butyl 4-[5-acetyl-6-[(6-methylsulfonyl-3-pyridyl)amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[5-acetyl-6-[(6-methylsulfonyl-3-pyridinyl)amino]-4-pyrimidinyl]oxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-acetyl-6-[(6-methylsulfonylpyridin-3-yl)amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[5-acetyl-6-[(6-mesyl-3-pyridyl)amino]pyrimidin-4-yl]oxypiperidine-1-carboxylic acid tert-butyl ester Formula: C22H29N5O6S MolecularWeight: 491.56056

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N=CN=C1OC2CCN(CC2)C(=O)OC(C)(C)C)NC3=CN=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(=O)C1=C(N=CN=C1OC2CCN(CC2)C(=O)OC(C)(C)C)NC3=CN=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H29N5O6S/c1-14(28)18-19(26-15-6-7-17(23-12-15)34(5,30)31)24-13-25-20(18)32-16-8-10-27(11-9-16)21(29)33-22(2,3)4/h6-7,12-13,16H,8-11H2,1-5H3,(H,24,25,26)