N-[3-(4-fluorophenyl)-3-oxidanyl-propyl]-2-[methyl-(phenylmethyl)amino]-4-phenyl-pyrimidine-5-carboxamide

Systemtic Name: N-[3-(4-fluorophenyl)-3-oxidanyl-propyl]-2-[methyl-(phenylmethyl)amino]-4-phenyl-pyrimidine-5-carboxamide Openeye Name: 2-[benzyl(methyl)amino]-N-[3-(4-fluorophenyl)-3-hydroxy-propyl]-4-phenyl-pyrimidine-5-carboxamide CAS Name: N-[3-(4-fluorophenyl)-3-hydroxypropyl]-2-[methyl-(phenylmethyl)amino]-4-phenyl-5-pyrimidinecarboxamide IUPAC Name: 2-[benzyl(methyl)amino]-N-[3-(4-fluorophenyl)-3-hydroxypropyl]-4-phenylpyrimidine-5-carboxamide Traditional Name: 2-[benzyl(methyl)amino]-N-[3-(4-fluorophenyl)-3-hydroxy-propyl]-4-phenyl-pyrimidine-5-carboxamide Formula: C28H27FN4O2 MolecularWeight: 470.537983

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=NC=C(C(=N2)C3=CC=CC=C3)C(=O)NCCC(C4=CC=C(C=C4)F)O

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=NC=C(C(=N2)C3=CC=CC=C3)C(=O)NCCC(C4=CC=C(C=C4)F)O

InChI

InChI=1S/C28H27FN4O2/c1-33(19-20-8-4-2-5-9-20)28-31-18-24(26(32-28)22-10-6-3-7-11-22)27(35)30-17-16-25(34)21-12-14-23(29)15-13-21/h2-15,18,25,34H,16-17,19H2,1H3,(H,30,35)