1-[4-[(2-morpholin-4-yl-6-phenyl-pyrimidin-4-yl)amino]phenyl]cyclobutane-1-carboxylic acid

Systemtic Name: 1-[4-[(2-morpholin-4-yl-6-phenyl-pyrimidin-4-yl)amino]phenyl]cyclobutane-1-carboxylic acid Openeye Name: 1-[4-[(2-morpholino-6-phenyl-pyrimidin-4-yl)amino]phenyl]cyclobutanecarboxylic acid CAS Name: 1-[4-[[2-(4-morpholinyl)-6-phenyl-4-pyrimidinyl]amino]phenyl]-1-cyclobutanecarboxylic acid IUPAC Name: 1-[4-[(2-morpholin-4-yl-6-phenylpyrimidin-4-yl)amino]phenyl]cyclobutane-1-carboxylic acid Traditional Name: 1-[4-[(2-morpholino-6-phenyl-pyrimidin-4-yl)amino]phenyl]cyclobutanecarboxylic acid Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(C2=CC=C(C=C2)NC3=NC(=NC(=C3)C4=CC=CC=C4)N5CCOCC5)C(=O)O

Isomeric SMILES

C1CC(C1)(C2=CC=C(C=C2)NC3=NC(=NC(=C3)C4=CC=CC=C4)N5CCOCC5)C(=O)O

InChI

InChI=1S/C25H26N4O3/c30-23(31)25(11-4-12-25)19-7-9-20(10-8-19)26-22-17-21(18-5-2-1-3-6-18)27-24(28-22)29-13-15-32-16-14-29/h1-3,5-10,17H,4,11-16H2,(H,30,31)(H,26,27,28)