tert-butyl 4-[4-[(4-cyano-2-fluoranyl-phenyl)amino]-6,7-dihydropyrimido[5,4-b][1,4]oxazin-8-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(4-cyano-2-fluoranyl-phenyl)amino]-6,7-dihydropyrimido[5,4-b][1,4]oxazin-8-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(4-cyano-2-fluoro-anilino)-6,7-dihydropyrimido[5,4-b][1,4]oxazin-8-yl]piperidine-1-carboxylate CAS Name: 4-[4-(4-cyano-2-fluoroanilino)-6,7-dihydropyrimido[5,4-b][1,4]oxazin-8-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(4-cyano-2-fluoroanilino)-6,7-dihydropyrimido[5,4-b][1,4]oxazin-8-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(4-cyano-2-fluoro-anilino)-6,7-dihydropyrimido[5,4-b][1,4]oxazin-8-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H27FN6O3 MolecularWeight: 454.497283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2CCOC3=C2N=CN=C3NC4=C(C=C(C=C4)C#N)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2CCOC3=C2N=CN=C3NC4=C(C=C(C=C4)C#N)F

InChI

InChI=1S/C23H27FN6O3/c1-23(2,3)33-22(31)29-8-6-16(7-9-29)30-10-11-32-19-20(26-14-27-21(19)30)28-18-5-4-15(13-25)12-17(18)24/h4-5,12,14,16H,6-11H2,1-3H3,(H,26,27,28)