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

Systemtic Name: (4-methylphenyl) 4-[4-[(2-fluoranyl-4-methylsulfonyl-phenyl)amino]-6,7-dihydropyrimido[5,4-b][1,4]oxazin-8-yl]piperidine-1-carboxylate Openeye Name: p-tolyl 4-[4-(2-fluoro-4-methylsulfonyl-anilino)-6,7-dihydropyrimido[5,4-b][1,4]oxazin-8-yl]piperidine-1-carboxylate CAS Name: 4-[4-(2-fluoro-4-methylsulfonylanilino)-6,7-dihydropyrimido[5,4-b][1,4]oxazin-8-yl]-1-piperidinecarboxylic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 4-[4-(2-fluoro-4-methylsulfonylanilino)-6,7-dihydropyrimido[5,4-b][1,4]oxazin-8-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(2-fluoro-4-mesyl-anilino)-6,7-dihydropyrimido[5,4-b][1,4]oxazin-8-yl]piperidine-1-carboxylic acid p-tolyl ester Formula: C26H28FN5O5S MolecularWeight: 541.594423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)N2CCC(CC2)N3CCOC4=C3N=CN=C4NC5=C(C=C(C=C5)S(=O)(=O)C)F

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)N2CCC(CC2)N3CCOC4=C3N=CN=C4NC5=C(C=C(C=C5)S(=O)(=O)C)F

InChI

InChI=1S/C26H28FN5O5S/c1-17-3-5-19(6-4-17)37-26(33)31-11-9-18(10-12-31)32-13-14-36-23-24(28-16-29-25(23)32)30-22-8-7-20(15-21(22)27)38(2,34)35/h3-8,15-16,18H,9-14H2,1-2H3,(H,28,29,30)