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

Systemtic Name: 4-(2-azanylpyrimidin-4-yl)-5-(4-fluorophenyl)-1-[2-(4-oxidanyl-6-oxidanylidene-oxan-2-yl)ethyl]-N-phenyl-2-propan-2-yl-pyrrole-3-carboxamide Openeye Name: 4-(2-aminopyrimidin-4-yl)-5-(4-fluorophenyl)-1-[2-(4-hydroxy-6-oxo-tetrahydropyran-2-yl)ethyl]-2-isopropyl-N-phenyl-pyrrole-3-carboxamide CAS Name: 4-(2-amino-4-pyrimidinyl)-5-(4-fluorophenyl)-1-[2-(4-hydroxy-6-oxo-2-oxanyl)ethyl]-N-phenyl-2-propan-2-yl-3-pyrrolecarboxamide IUPAC Name: 4-(2-aminopyrimidin-4-yl)-5-(4-fluorophenyl)-1-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-N-phenyl-2-propan-2-ylpyrrole-3-carboxamide Traditional Name: 4-(2-aminopyrimidin-4-yl)-5-(4-fluorophenyl)-1-[2-(4-hydroxy-6-keto-tetrahydropyran-2-yl)ethyl]-2-isopropyl-N-phenyl-pyrrole-3-carboxamide Formula: C31H32FN5O4 MolecularWeight: 557.615283

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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)N)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)N)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C31H32FN5O4/c1-18(2)28-27(30(40)35-21-6-4-3-5-7-21)26(24-12-14-34-31(33)36-24)29(19-8-10-20(32)11-9-19)37(28)15-13-23-16-22(38)17-25(39)41-23/h3-12,14,18,22-23,38H,13,15-17H2,1-2H3,(H,35,40)(H2,33,34,36)