N-(4-methylsulfonylphenyl)-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-(4-methylsulfonylphenyl)-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-(4-methylsulfonylphenyl)-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-(4-methylsulfonylphenyl)-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-(4-methylsulfonylphenyl)-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: 4-(4-ketoquinazolin-3-yl)-N-(4-mesylphenyl)butyramide Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H19N3O4S/c1-27(25,26)15-10-8-14(9-11-15)21-18(23)7-4-12-22-13-20-17-6-3-2-5-16(17)19(22)24/h2-3,5-6,8-11,13H,4,7,12H2,1H3,(H,21,23)