sodium; 3-(4-fluoranylnaphthalen-1-yl)-5-propan-2-yl-4H-pyrimidine; oxolan-2-ylmethylazanide

Systemtic Name: sodium; 3-(4-fluoranylnaphthalen-1-yl)-5-propan-2-yl-4H-pyrimidine; oxolan-2-ylmethylazanide Openeye Name: sodium; 3-(4-fluoro-1-naphthyl)-5-isopropyl-4H-pyrimidine; tetrahydrofuran-2-ylmethylazanide CAS Name: sodium; 3-(4-fluoro-1-naphthalenyl)-5-propan-2-yl-4H-pyrimidine; 2-oxolanylmethylazanide IUPAC Name: sodium; 3-(4-fluoronaphthalen-1-yl)-5-propan-2-yl-4H-pyrimidine; oxolan-2-ylmethylazanide Traditional Name: sodium; 3-(4-fluoro-1-naphthyl)-5-isopropyl-4H-pyrimidine; tetrahydrofurfurylazanide Formula: C22H27FN3NaO MolecularWeight: 391.457453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CN=CN(C1)C2=CC=C(C3=CC=CC=C32)F.C1CC(OC1)C[NH-].[Na+]

Isomeric SMILES

CC(C)C1=CN=CN(C1)C2=CC=C(C3=CC=CC=C32)F.C1CC(OC1)C[NH-].[Na+]

InChI

InChI=1S/C17H17FN2.C5H10NO.Na/c1-12(2)13-9-19-11-20(10-13)17-8-7-16(18)14-5-3-4-6-15(14)17;6-4-5-2-1-3-7-5;/h3-9,11-12H,10H2,1-2H3;5-6H,1-4H2;/q;-1;+1