N-[2-(fluoranylmethyl)-3-(2-methylphenyl)-4-oxidanylidene-quinazolin-6-yl]pentanamide

Systemtic Name: N-[2-(fluoranylmethyl)-3-(2-methylphenyl)-4-oxidanylidene-quinazolin-6-yl]pentanamide Openeye Name: N-[2-(fluoromethyl)-3-(o-tolyl)-4-oxo-quinazolin-6-yl]pentanamide CAS Name: N-[2-(fluoromethyl)-3-(2-methylphenyl)-4-oxo-6-quinazolinyl]pentanamide IUPAC Name: N-[2-(fluoromethyl)-3-(2-methylphenyl)-4-oxoquinazolin-6-yl]pentanamide Traditional Name: N-[2-(fluoromethyl)-4-keto-3-(o-tolyl)quinazolin-6-yl]valeramide Formula: C21H22FN3O2 MolecularWeight: 367.416683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC2=C(C=C1)N=C(N(C2=O)C3=CC=CC=C3C)CF

Isomeric SMILES

CCCCC(=O)NC1=CC2=C(C=C1)N=C(N(C2=O)C3=CC=CC=C3C)CF

InChI

InChI=1S/C21H22FN3O2/c1-3-4-9-20(26)23-15-10-11-17-16(12-15)21(27)25(19(13-22)24-17)18-8-6-5-7-14(18)2/h5-8,10-12H,3-4,9,13H2,1-2H3,(H,23,26)