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

Systemtic Name: 1-[4-[(4-phenyl-6-propan-2-yloxy-pyrimidin-2-yl)amino]phenyl]cyclobutane-1-carboxylic acid Openeye Name: 1-[4-[(4-isopropoxy-6-phenyl-pyrimidin-2-yl)amino]phenyl]cyclobutanecarboxylic acid CAS Name: 1-[4-[(4-phenyl-6-propan-2-yloxy-2-pyrimidinyl)amino]phenyl]-1-cyclobutanecarboxylic acid IUPAC Name: 1-[4-[(4-phenyl-6-propan-2-yloxypyrimidin-2-yl)amino]phenyl]cyclobutane-1-carboxylic acid Traditional Name: 1-[4-[(4-isopropoxy-6-phenyl-pyrimidin-2-yl)amino]phenyl]cyclobutanecarboxylic acid Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC(=NC(=C1)C2=CC=CC=C2)NC3=CC=C(C=C3)C4(CCC4)C(=O)O

Isomeric SMILES

CC(C)OC1=NC(=NC(=C1)C2=CC=CC=C2)NC3=CC=C(C=C3)C4(CCC4)C(=O)O

InChI

InChI=1S/C24H25N3O3/c1-16(2)30-21-15-20(17-7-4-3-5-8-17)26-23(27-21)25-19-11-9-18(10-12-19)24(22(28)29)13-6-14-24/h3-5,7-12,15-16H,6,13-14H2,1-2H3,(H,28,29)(H,25,26,27)