3-[2-(4-fluorophenyl)-2-oxidanyl-5-oxidanylidene-4-propan-2-yl-3-pyridin-4-yl-pyrrol-1-yl]propanenitrile

Systemtic Name: 3-[2-(4-fluorophenyl)-2-oxidanyl-5-oxidanylidene-4-propan-2-yl-3-pyridin-4-yl-pyrrol-1-yl]propanenitrile Openeye Name: 3-[2-(4-fluorophenyl)-2-hydroxy-4-isopropyl-5-oxo-3-(4-pyridyl)pyrrol-1-yl]propanenitrile CAS Name: 3-[2-(4-fluorophenyl)-2-hydroxy-5-oxo-4-propan-2-yl-3-pyridin-4-yl-1-pyrrolyl]propanenitrile IUPAC Name: 3-[2-(4-fluorophenyl)-2-hydroxy-5-oxo-4-propan-2-yl-3-pyridin-4-ylpyrrol-1-yl]propanenitrile Traditional Name: 3-[2-(4-fluorophenyl)-2-hydroxy-4-isopropyl-5-keto-3-(4-pyridyl)-3-pyrrolin-1-yl]propionitrile Formula: C21H20FN3O2 MolecularWeight: 365.400803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(N(C1=O)CCC#N)(C2=CC=C(C=C2)F)O)C3=CC=NC=C3

Isomeric SMILES

CC(C)C1=C(C(N(C1=O)CCC#N)(C2=CC=C(C=C2)F)O)C3=CC=NC=C3

InChI

InChI=1S/C21H20FN3O2/c1-14(2)18-19(15-8-11-24-12-9-15)21(27,16-4-6-17(22)7-5-16)25(20(18)26)13-3-10-23/h4-9,11-12,14,27H,3,13H2,1-2H3