propan-2-yl 4-[6-[(2-fluoranyl-4-methylsulfonyl-phenyl)amino]-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[6-[(2-fluoranyl-4-methylsulfonyl-phenyl)amino]-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylate Openeye Name: isopropyl 4-[6-(2-fluoro-4-methylsulfonyl-anilino)-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[6-(2-fluoro-4-methylsulfonylanilino)-5-methoxy-4-pyrimidinyl]oxy]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[6-(2-fluoro-4-methylsulfonylanilino)-5-methoxypyrimidin-4-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[6-(2-fluoro-4-mesyl-anilino)-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylic acid isopropyl ester Formula: C21H27FN4O6S MolecularWeight: 482.525683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)OC2=NC=NC(=C2OC)NC3=C(C=C(C=C3)S(=O)(=O)C)F

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)OC2=NC=NC(=C2OC)NC3=C(C=C(C=C3)S(=O)(=O)C)F

InChI

InChI=1S/C21H27FN4O6S/c1-13(2)31-21(27)26-9-7-14(8-10-26)32-20-18(30-3)19(23-12-24-20)25-17-6-5-15(11-16(17)22)33(4,28)29/h5-6,11-14H,7-10H2,1-4H3,(H,23,24,25)