N-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-methyl-2-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-methyl-2-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-2-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-2-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-2-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-ketoquinazolin-3-yl)-3-methyl-butyramide Formula: C20H17ClF3N3O2 MolecularWeight: 423.81609

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=C(C=CC(=C1)C(F)(F)F)Cl)N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)C(C(=O)NC1=C(C=CC(=C1)C(F)(F)F)Cl)N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H17ClF3N3O2/c1-11(2)17(27-10-25-15-6-4-3-5-13(15)19(27)29)18(28)26-16-9-12(20(22,23)24)7-8-14(16)21/h3-11,17H,1-2H3,(H,26,28)