3-(2-methylpropoxy)-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]benzamide

Systemtic Name: 3-(2-methylpropoxy)-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]benzamide Openeye Name: 3-isobutoxy-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]benzamide CAS Name: 3-(2-methylpropoxy)-N-[4-[(6-phenyl-4-pyrimidinyl)amino]phenyl]benzamide IUPAC Name: 3-(2-methylpropoxy)-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]benzamide Traditional Name: 3-isobutoxy-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]benzamide Formula: C27H26N4O2 MolecularWeight: 438.52094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC3=NC=NC(=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC3=NC=NC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O2/c1-19(2)17-33-24-10-6-9-21(15-24)27(32)31-23-13-11-22(12-14-23)30-26-16-25(28-18-29-26)20-7-4-3-5-8-20/h3-16,18-19H,17H2,1-2H3,(H,31,32)(H,28,29,30)