5-(4-fluorophenyl)-1-[2-(4-oxidanyl-6-oxidanylidene-oxan-2-yl)ethyl]-N-phenyl-2-propan-2-yl-4-pyrimidin-4-yl-pyrrole-3-carboxamide

Systemtic Name: 5-(4-fluorophenyl)-1-[2-(4-oxidanyl-6-oxidanylidene-oxan-2-yl)ethyl]-N-phenyl-2-propan-2-yl-4-pyrimidin-4-yl-pyrrole-3-carboxamide Openeye Name: 5-(4-fluorophenyl)-1-[2-(4-hydroxy-6-oxo-tetrahydropyran-2-yl)ethyl]-2-isopropyl-N-phenyl-4-pyrimidin-4-yl-pyrrole-3-carboxamide CAS Name: 5-(4-fluorophenyl)-1-[2-(4-hydroxy-6-oxo-2-oxanyl)ethyl]-N-phenyl-2-propan-2-yl-4-(4-pyrimidinyl)-3-pyrrolecarboxamide IUPAC Name: 5-(4-fluorophenyl)-1-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-N-phenyl-2-propan-2-yl-4-pyrimidin-4-ylpyrrole-3-carboxamide Traditional Name: 5-(4-fluorophenyl)-1-[2-(4-hydroxy-6-keto-tetrahydropyran-2-yl)ethyl]-2-isopropyl-N-phenyl-4-(4-pyrimidyl)pyrrole-3-carboxamide Formula: C31H31FN4O4 MolecularWeight: 542.600643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(N1CCC2CC(CC(=O)O2)O)C3=CC=C(C=C3)F)C4=NC=NC=C4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CC(C)C1=C(C(=C(N1CCC2CC(CC(=O)O2)O)C3=CC=C(C=C3)F)C4=NC=NC=C4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C31H31FN4O4/c1-19(2)29-28(31(39)35-22-6-4-3-5-7-22)27(25-12-14-33-18-34-25)30(20-8-10-21(32)11-9-20)36(29)15-13-24-16-23(37)17-26(38)40-24/h3-12,14,18-19,23-24,37H,13,15-17H2,1-2H3,(H,35,39)