N-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-4-chloranyl-3-[2-(piperidin-4-ylamino)pyrimidin-4-yl]oxy-benzamide

Systemtic Name: N-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-4-chloranyl-3-[2-(piperidin-4-ylamino)pyrimidin-4-yl]oxy-benzamide Openeye Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-4-chloro-3-[2-(4-piperidylamino)pyrimidin-4-yl]oxy-benzamide CAS Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-4-chloro-3-[[2-(4-piperidinylamino)-4-pyrimidinyl]oxy]benzamide IUPAC Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-4-chloro-3-[2-(piperidin-4-ylamino)pyrimidin-4-yl]oxybenzamide Traditional Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-4-chloro-3-[2-(4-piperidylamino)pyrimidin-4-yl]oxy-benzamide Formula: C28H35ClN6O5S MolecularWeight: 603.1327

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)NS(=O)(=O)C)OC)NC(=O)C2=CC(=C(C=C2)Cl)OC3=NC(=NC=C3)NC4CCNCC4

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)NS(=O)(=O)C)OC)NC(=O)C2=CC(=C(C=C2)Cl)OC3=NC(=NC=C3)NC4CCNCC4

InChI

InChI=1S/C28H35ClN6O5S/c1-28(2,3)18-15-21(25(39-4)22(16-18)35-41(5,37)38)33-26(36)17-6-7-20(29)23(14-17)40-24-10-13-31-27(34-24)32-19-8-11-30-12-9-19/h6-7,10,13-16,19,30,35H,8-9,11-12H2,1-5H3,(H,33,36)(H,31,32,34)