N-[2-[5-(4-fluorophenyl)-1-methyl-6-oxidanylidene-2-(3-phenylpropylamino)pyrimidin-4-yl]pyridin-4-yl]ethanamide

Systemtic Name: N-[2-[5-(4-fluorophenyl)-1-methyl-6-oxidanylidene-2-(3-phenylpropylamino)pyrimidin-4-yl]pyridin-4-yl]ethanamide Openeye Name: N-[2-[5-(4-fluorophenyl)-1-methyl-6-oxo-2-(3-phenylpropylamino)pyrimidin-4-yl]-4-pyridyl]acetamide CAS Name: N-[2-[5-(4-fluorophenyl)-1-methyl-6-oxo-2-(3-phenylpropylamino)-4-pyrimidinyl]-4-pyridinyl]acetamide IUPAC Name: N-[2-[5-(4-fluorophenyl)-1-methyl-6-oxo-2-(3-phenylpropylamino)pyrimidin-4-yl]pyridin-4-yl]acetamide Traditional Name: N-[2-[5-(4-fluorophenyl)-6-keto-1-methyl-2-(3-phenylpropylamino)pyrimidin-4-yl]-4-pyridyl]acetamide Formula: C27H26FN5O2 MolecularWeight: 471.526043

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=NC=C1)C2=C(C(=O)N(C(=N2)NCCCC3=CC=CC=C3)C)C4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)NC1=CC(=NC=C1)C2=C(C(=O)N(C(=N2)NCCCC3=CC=CC=C3)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H26FN5O2/c1-18(34)31-22-14-16-29-23(17-22)25-24(20-10-12-21(28)13-11-20)26(35)33(2)27(32-25)30-15-6-9-19-7-4-3-5-8-19/h3-5,7-8,10-14,16-17H,6,9,15H2,1-2H3,(H,30,32)(H,29,31,34)