(2S)-N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-methyl-2-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: (2S)-N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-methyl-2-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: (2S)-N-(5-chloro-2,4-dimethoxy-phenyl)-3-methyl-2-(4-oxoquinazolin-3-yl)butanamide CAS Name: (2S)-N-(5-chloro-2,4-dimethoxyphenyl)-3-methyl-2-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: (2S)-N-(5-chloro-2,4-dimethoxyphenyl)-3-methyl-2-(4-oxoquinazolin-3-yl)butanamide Traditional Name: (2S)-N-(5-chloro-2,4-dimethoxy-phenyl)-2-(4-ketoquinazolin-3-yl)-3-methyl-butyramide Formula: C21H22ClN3O4 MolecularWeight: 415.87008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC(=C(C=C1OC)OC)Cl)N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC(=C(C=C1OC)OC)Cl)N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H22ClN3O4/c1-12(2)19(25-11-23-15-8-6-5-7-13(15)21(25)27)20(26)24-16-9-14(22)17(28-3)10-18(16)29-4/h5-12,19H,1-4H3,(H,24,26)/t19-/m0/s1