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

Systemtic Name: propan-2-yl 4-[6-[[6-(2-hydroxyethylsulfonyl)-2-methyl-pyridin-3-yl]amino]-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylate Openeye Name: isopropyl 4-[6-[[6-(2-hydroxyethylsulfonyl)-2-methyl-3-pyridyl]amino]-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[6-[[6-(2-hydroxyethylsulfonyl)-2-methyl-3-pyridinyl]amino]-5-methoxy-4-pyrimidinyl]oxy]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[6-[[6-(2-hydroxyethylsulfonyl)-2-methylpyridin-3-yl]amino]-5-methoxypyrimidin-4-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[6-[[6-(2-hydroxyethylsulfonyl)-2-methyl-3-pyridyl]amino]-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylic acid isopropyl ester Formula: C22H31N5O7S MolecularWeight: 509.57584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)S(=O)(=O)CCO)NC2=C(C(=NC=N2)OC3CCN(CC3)C(=O)OC(C)C)OC

Isomeric SMILES

CC1=C(C=CC(=N1)S(=O)(=O)CCO)NC2=C(C(=NC=N2)OC3CCN(CC3)C(=O)OC(C)C)OC

InChI

InChI=1S/C22H31N5O7S/c1-14(2)33-22(29)27-9-7-16(8-10-27)34-21-19(32-4)20(23-13-24-21)26-17-5-6-18(25-15(17)3)35(30,31)12-11-28/h5-6,13-14,16,28H,7-12H2,1-4H3,(H,23,24,26)