propan-2-yl 4-[5-cyano-6-[[2-fluoranyl-4-(2-pyrrolidin-1-ylethylamino)phenyl]amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[5-cyano-6-[[2-fluoranyl-4-(2-pyrrolidin-1-ylethylamino)phenyl]amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate Openeye Name: isopropyl 4-[5-cyano-6-[2-fluoro-4-(2-pyrrolidin-1-ylethylamino)anilino]pyrimidin-4-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[5-cyano-6-[2-fluoro-4-[2-(1-pyrrolidinyl)ethylamino]anilino]-4-pyrimidinyl]oxy]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[5-cyano-6-[2-fluoro-4-(2-pyrrolidin-1-ylethylamino)anilino]pyrimidin-4-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[5-cyano-6-[2-fluoro-4-(2-pyrrolidinoethylamino)anilino]pyrimidin-4-yl]oxypiperidine-1-carboxylic acid isopropyl ester Formula: C26H34FN7O3 MolecularWeight: 511.591663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)OC2=NC=NC(=C2C#N)NC3=C(C=C(C=C3)NCCN4CCCC4)F

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)OC2=NC=NC(=C2C#N)NC3=C(C=C(C=C3)NCCN4CCCC4)F

InChI

InChI=1S/C26H34FN7O3/c1-18(2)36-26(35)34-12-7-20(8-13-34)37-25-21(16-28)24(30-17-31-25)32-23-6-5-19(15-22(23)27)29-9-14-33-10-3-4-11-33/h5-6,15,17-18,20,29H,3-4,7-14H2,1-2H3,(H,30,31,32)