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

Systemtic Name: propan-2-yl 4-[6-[[2-fluoranyl-4-(2-hydroxyethylsulfanyl)phenyl]amino]-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylate Openeye Name: isopropyl 4-[6-[2-fluoro-4-(2-hydroxyethylsulfanyl)anilino]-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[6-[2-fluoro-4-(2-hydroxyethylthio)anilino]-5-methoxy-4-pyrimidinyl]oxy]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[6-[2-fluoro-4-(2-hydroxyethylsulfanyl)anilino]-5-methoxypyrimidin-4-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[6-[2-fluoro-4-(2-hydroxyethylthio)anilino]-5-methoxy-pyrimidin-4-yl]oxypiperidine-1-carboxylic acid isopropyl ester Formula: C22H29FN4O5S MolecularWeight: 480.552863

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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)SCCO)F

Isomeric SMILES

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

InChI

InChI=1S/C22H29FN4O5S/c1-14(2)31-22(29)27-8-6-15(7-9-27)32-21-19(30-3)20(24-13-25-21)26-18-5-4-16(12-17(18)23)33-11-10-28/h4-5,12-15,28H,6-11H2,1-3H3,(H,24,25,26)