1-[4-[[2-(6-methylpyridin-3-yl)-6-phenyl-pyrimidin-4-yl]amino]phenyl]cyclobutane-1-carboxylic acid

Systemtic Name: 1-[4-[[2-(6-methylpyridin-3-yl)-6-phenyl-pyrimidin-4-yl]amino]phenyl]cyclobutane-1-carboxylic acid Openeye Name: 1-[4-[[2-(6-methyl-3-pyridyl)-6-phenyl-pyrimidin-4-yl]amino]phenyl]cyclobutanecarboxylic acid CAS Name: 1-[4-[[2-(6-methyl-3-pyridinyl)-6-phenyl-4-pyrimidinyl]amino]phenyl]-1-cyclobutanecarboxylic acid IUPAC Name: 1-[4-[[2-(6-methylpyridin-3-yl)-6-phenylpyrimidin-4-yl]amino]phenyl]cyclobutane-1-carboxylic acid Traditional Name: 1-[4-[[2-(6-methyl-3-pyridyl)-6-phenyl-pyrimidin-4-yl]amino]phenyl]cyclobutanecarboxylic acid Formula: C27H24N4O2 MolecularWeight: 436.50506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C2=NC(=CC(=N2)NC3=CC=C(C=C3)C4(CCC4)C(=O)O)C5=CC=CC=C5

Isomeric SMILES

CC1=NC=C(C=C1)C2=NC(=CC(=N2)NC3=CC=C(C=C3)C4(CCC4)C(=O)O)C5=CC=CC=C5

InChI

InChI=1S/C27H24N4O2/c1-18-8-9-20(17-28-18)25-30-23(19-6-3-2-4-7-19)16-24(31-25)29-22-12-10-21(11-13-22)27(26(32)33)14-5-15-27/h2-4,6-13,16-17H,5,14-15H2,1H3,(H,32,33)(H,29,30,31)